Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 19 results

Search term: ZYJPUMXJBDHSIF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
70249

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1
C14H19NO4265.3051271314392
553211

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m1/s1
C14H19NO4265.305121832311
237156

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)
C14H19NO4265.305103137537
17344955

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1/i4D,5D,6D,7D,8D
C14H14D5NO4270.3358211800
8576139

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1/i15+1
C14H1915NO4266.2984121300
21170225

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1/i4D,5D,6D,7D,8D,9D2,11D
C14H11D8NO4273.3543111000
17341031

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1/i12+1
C1313CH19NO4266.2976101100
17341298

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1/i9+1
C1313CH19NO4266.297691100
24533029

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m1/s1/i4D,5D,6D,7D,8D
C14H14D5NO4270.33589800
9000942

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1/i11D
C14H18DNO4266.31116500
49071306

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1/i11+1
C1313CH19NO4266.29764300
17341296

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1/i13+1
C1313CH19NO4266.29764400
8621035

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m1/s1/i15+1
C14H1915NO4266.29843200
8621247

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1/i9D2,11+1,12+1,15+1
C1213C2H17D215NO4270.2962200
8237104

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1/i11+1,12+1,15+1
C1213C2H1915NO4268.28372200
17341032

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/i4D,5D,6D,7D,8D,9D2,11D
C14H11D8NO4273.35432100
1267650

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/p-1/t11-/m0/s1
C14H18NO4264.29761100
1415254

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/p-1/t11-/m1/s1
C14H18NO4264.29761100

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