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 6 results

Search term: MSEUQISSMRSQFO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2125735

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H21NO3/c1-10(9-15-2)14-8-11-6-5-7-12(16-3)13(11)17-4/h5-7,10,14H,8-9H2,1-4H3
C13H21NO3239.31074413400
677855

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H21NO3/c1-10(9-15-2)14-8-11-6-5-7-12(16-3)13(11)17-4/h5-7,10,14H,8-9H2,1-4H3/t10-/m1/s1
C13H21NO3239.31073100
677856

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H21NO3/c1-10(9-15-2)14-8-11-6-5-7-12(16-3)13(11)17-4/h5-7,10,14H,8-9H2,1-4H3/t10-/m0/s1
C13H21NO3239.31073100
3929795

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H21NO3/c1-10(9-15-2)14-8-11-6-5-7-12(16-3)13(11)17-4/h5-7,10,14H,8-9H2,1-4H3/p+1
C13H22NO3240.31811100
5315436

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H21NO3/c1-10(9-15-2)14-8-11-6-5-7-12(16-3)13(11)17-4/h5-7,10,14H,8-9H2,1-4H3/p+1/t10-/m0/s1
C13H22NO3240.318681100
5315437

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H21NO3/c1-10(9-15-2)14-8-11-6-5-7-12(16-3)13(11)17-4/h5-7,10,14H,8-9H2,1-4H3/p+1/t10-/m1/s1
C13H22NO3240.318681100

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