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: NPJBOTRZBRXWCV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17207166

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H13BrO2/c1-8(2)10-6-7(11-8)4-3-5-9/h3-4,7H,5-6H2,1-2H3/b4-3+/t7-/m0/s1
C8H13BrO2221.0916121000
17207149

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H13BrO2/c1-8(2)10-6-7(11-8)4-3-5-9/h3-4,7H,5-6H2,1-2H3/b4-3+/t7-/m1/s1
C8H13BrO2221.09164200
9565302

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H13BrO2/c1-8(2)10-6-7(11-8)4-3-5-9/h3-4,7H,5-6H2,1-2H3/b4-3-/t7-/m0/s1
C8H13BrO2221.09162100
60654255

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C8H13BrO2/c1-8(2)10-6-7(11-8)4-3-5-9/h3-4,7H,5-6H2,1-2H3/b4-3+
C8H13BrO2221.09162200
68896121

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H13BrO2/c1-8(2)10-6-7(11-8)4-3-5-9/h3-4,7H,5-6H2,1-2H3/t7-/m0/s1
C8H13BrO2221.09162100
75257812

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C8H13BrO2/c1-8(2)10-6-7(11-8)4-3-5-9/h3-4,7H,5-6H2,1-2H3/t7-/m1/s1
C8H13BrO2221.09161100
76600111

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C8H13BrO2/c1-8(2)10-6-7(11-8)4-3-5-9/h3-4,7H,5-6H2,1-2H3
C8H13BrO2221.09161100

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