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 14 results

Search term: UIKROCXWUNQSPJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
746405

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1
C10H12N2O176.2151109236322664
395

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3
C10H12N2O176.215185198630
20591

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m1/s1
C10H12N2O176.2151292400
17341134

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/i1D3
C10H9D3N2O179.2336264100
21403059

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/i2D,3D,6D,7D
C10H8D4N2O180.23979600
29367479

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1/i1D3
C10H9D3N2O179.23366800
48057765

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/i1+1D3
C913CH9D3N2O180.22626700
68023523

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/i1+1
C913CH12N2O177.20773200
111328884

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/i1D3,2D,3D,6D,7D
C10H5D7N2O183.25822200
8830256

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1/i9+2
C914CH12N2O178.20762100
10142843

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1/i1-1
C911CH12N2O175.21582200
58793461

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/i2D,3D,4+1,6D,7D,9+1
C813C2H8D4N2O182.2251100
111328779

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/i1D3,5D2
C10H7D5N2O181.24591100
111328843

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/i1D3,5D2,9D
C10H6D6N2O182.25211100

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