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cyclohex-1,4-dienecarboxylate

PropertiesImage
MNX_IDMNXM104176 Image of MNXM104176
referencechebi:188486
formulaC7H7O2
global charge-1
mol weight123.131
InChIKeyXCSQXCKDEVRTHN-UHFFFAOYSA-M
InChIInChI=1S/C7H8O2/c8-7(9)6-4-2-1-3-5-6/h1-2,5H,3-4H2,(H,8,9)/p-1
SMILESO=C([O-])C1=CCC=CC1
MNX internals
InChI (mnx)InChI=1/C7H8O2/c8-7(9)6-4-2-1-3-5-6/h1-2,5H,3-4H2,(H,8,9) Image of MNXM104176
SMILES (mnx)[CH:1]1=[CH:2][CH2:4][C:6]([C:7](=[O:8])[OH:9])=[CH:5][CH2:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:188486
chebi:188486
XCSQXCKDEVRTHN-UHFFFAOYSA-M 		cyclohex-1,4-dienecarboxylate
cyclohexa-1,4-diene-1-carboxylate

seed.compound:cpd24332
seedM:cpd24332
XCSQXCKDEVRTHN-UHFFFAOYSA-M 		1,4-cyclohexadiene-1-carboxylic acid
cyclohex-1,4-dienecarboxylate
cyclohexa-1,4-diene-1-carboxylic acid

metacyc.compound:CPD-14382
metacycM:CPD-14382
XCSQXCKDEVRTHN-UHFFFAOYSA-M 		cyclohex-1,4-dienecarboxylate
1,4-cyclohexadiene-1-carboxylic acid
cyclohexa-1,4-diene-1-carboxylic acid

seedM:M_cpd24332 		secondary/obsolete/fantasy identifier