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 8 results

Search term: XFGVJLGVINCWDP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
228065

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C6H10F3NO2/c1-3(6(7,8)9)2-4(10)5(11)12/h3-4H,2,10H2,1H3,(H,11,12)
C6H10F3NO2185.14437774216
144284

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C6H10F3NO2/c1-3(6(7,8)9)2-4(10)5(11)12/h3-4H,2,10H2,1H3,(H,11,12)/t3?,4-/m0/s1
C6H10F3NO2185.1443152782
5360803

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H10F3NO2/c1-3(6(7,8)9)2-4(10)5(11)12/h3-4H,2,10H2,1H3,(H,11,12)/t3-,4-/m0/s1
C6H10F3NO2185.14435500
5360805

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H10F3NO2/c1-3(6(7,8)9)2-4(10)5(11)12/h3-4H,2,10H2,1H3,(H,11,12)/t3-,4+/m1/s1
C6H10F3NO2185.14434400
5360807

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H10F3NO2/c1-3(6(7,8)9)2-4(10)5(11)12/h3-4H,2,10H2,1H3,(H,11,12)/t3-,4+/m0/s1
C6H10F3NO2185.14434400
5360809

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H10F3NO2/c1-3(6(7,8)9)2-4(10)5(11)12/h3-4H,2,10H2,1H3,(H,11,12)/t3-,4-/m1/s1
C6H10F3NO2185.14434300
31043200

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C6H10F3NO2/c1-3(6(7,8)9)2-4(10)5(11)12/h3-4H,2,10H2,1H3,(H,11,12)/t3?,4-/m1/s1
C6H10F3NO2185.14434200
75560340

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C6H10F3NO2/c1-3(6(7,8)9)2-4(10)5(11)12/h3-4H,2,10H2,1H3,(H,11,12)/t3-,4?/m0/s1
C6H10F3NO2185.14431100

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