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 10 results

Search term: MFFWEFPNGDBSLN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
560822

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C12H17NO3/c14-11(13-7-3-4-8-13)9-5-1-2-6-10(9)12(15)16/h1-2,9-10H,3-8H2,(H,15,16)
C12H17NO3223.2683584100
735171

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H17NO3/c14-11(13-7-3-4-8-13)9-5-1-2-6-10(9)12(15)16/h1-2,9-10H,3-8H2,(H,15,16)/t9-,10+/m1/s1
C12H17NO3223.26834300
735167

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H17NO3/c14-11(13-7-3-4-8-13)9-5-1-2-6-10(9)12(15)16/h1-2,9-10H,3-8H2,(H,15,16)/t9-,10-/m0/s1
C12H17NO3223.26832100
5322200

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H17NO3/c14-11(13-7-3-4-8-13)9-5-1-2-6-10(9)12(15)16/h1-2,9-10H,3-8H2,(H,15,16)/t9-,10+/m0/s1
C12H17NO3223.268282100
5024264

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H17NO3/c14-11(13-7-3-4-8-13)9-5-1-2-6-10(9)12(15)16/h1-2,9-10H,3-8H2,(H,15,16)/t9-,10-/m1/s1
C12H17NO3223.26832100
5322199

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H17NO3/c14-11(13-7-3-4-8-13)9-5-1-2-6-10(9)12(15)16/h1-2,9-10H,3-8H2,(H,15,16)/p-1/t9-,10+/m0/s1
C12H16NO3222.260341100
5322201

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H17NO3/c14-11(13-7-3-4-8-13)9-5-1-2-6-10(9)12(15)16/h1-2,9-10H,3-8H2,(H,15,16)/p-1/t9-,10-/m1/s1
C12H16NO3222.260341100
5460688

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H17NO3/c14-11(13-7-3-4-8-13)9-5-1-2-6-10(9)12(15)16/h1-2,9-10H,3-8H2,(H,15,16)/p-1/t9-,10+/m1/s1
C12H16NO3222.26091100
5460689

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C12H17NO3/c14-11(13-7-3-4-8-13)9-5-1-2-6-10(9)12(15)16/h1-2,9-10H,3-8H2,(H,15,16)/p-1/t9-,10-/m0/s1
C12H16NO3222.26091100
3931870

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C12H17NO3/c14-11(13-7-3-4-8-13)9-5-1-2-6-10(9)12(15)16/h1-2,9-10H,3-8H2,(H,15,16)/p-1
C12H16NO3222.26091100

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