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 7 results

Search term: BXYPVKMROLGXJI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
13696

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C10H13N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h3-4,6,8,10H,1-2,5,7H2
C10H13N3O191.229761113431
5424103

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C10H13N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h3-4,6,8,10H,1-2,5,7H2/t10-/m0/s1
C10H13N3O191.2297202500
23936902

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H13N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h3-4,6,8,10H,1-2,5,7H2/i3D,4D,6D,8D
C10H9D4N3O195.2544131600
5424104

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C10H13N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h3-4,6,8,10H,1-2,5,7H2/t10-/m1/s1
C10H13N3O191.22979800
34451933

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H13N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h3-4,6,8,10H,1-2,5,7H2/t10-/m0/s1/i3D,4D,6D,8D
C10H9D4N3O195.25442300
58784646

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C10H13N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h3-4,6,8,10H,1-2,5,7H2/i3+1,4+1,6+1,8+1,9+1,10+1
C413C6H13N3O197.18562200
107450579

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C10H13N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h3-4,6,8,10H,1-2,5,7H2/t10-/m1/s1/i3D,4D,6D,8D
C10H9D4N3O195.25441100

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