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 5 results

Search term: ITMWMUMGRHXBTK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2395708

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H17N3O/c1-2-15-13(17)11(14)7-9-8-16-12-6-4-3-5-10(9)12/h3-6,8,11,16H,2,7,14H2,1H3,(H,15,17)
C13H17N3O231.29358372200
963475

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H17N3O/c1-2-15-13(17)11(14)7-9-8-16-12-6-4-3-5-10(9)12/h3-6,8,11,16H,2,7,14H2,1H3,(H,15,17)/t11-/m0/s1
C13H17N3O231.29366700
963473

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H17N3O/c1-2-15-13(17)11(14)7-9-8-16-12-6-4-3-5-10(9)12/h3-6,8,11,16H,2,7,14H2,1H3,(H,15,17)/t11-/m1/s1
C13H17N3O231.29365300
5340843

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H17N3O/c1-2-15-13(17)11(14)7-9-8-16-12-6-4-3-5-10(9)12/h3-6,8,11,16H,2,7,14H2,1H3,(H,15,17)/p+1/t11-/m1/s1
C13H18N3O232.3011100
5340844

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H17N3O/c1-2-15-13(17)11(14)7-9-8-16-12-6-4-3-5-10(9)12/h3-6,8,11,16H,2,7,14H2,1H3,(H,15,17)/p+1/t11-/m0/s1
C13H18N3O232.3011100

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