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(5S,6R)-5,6-Dihydroxy-cyclohexa-1,3-dienecarboxylic acid ethyl ester
SpectraBase Compound ID 2SIPg8BUk9
InChI InChI=1S/C9H12O4/c1-2-13-9(12)6-4-3-5-7(10)8(6)11/h3-5,7-8,10-11H,2H2,1H3/t7-,8+/m0/s1
InChIKey PVNFBEBEYXTGJC-JGVFFNPUSA-N
Mol Weight 184.19 g/mol
Molecular Formula C9H12O4
Exact Mass 184.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IphAT4n5vgw
Name (5S,6R)-5,6-Dihydroxy-cyclohexa-1,3-dienecarboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c1-2-13-9(12)6-4-3-5-7(10)8(6)11/h3-5,7-8,10-11H,2H2,1H3/t7-,8+/m0/s1
InChIKey PVNFBEBEYXTGJC-JGVFFNPUSA-N
Molecular Weight 184.191 g/mol
SMILES O[C@]1(C=CC=C([C@]1(O)[H])C(=O)OCC)[H]
SPLASH splash10-0ab9-2900000000-65ac65c60dec7243321d
Source of Spectrum F5-7-2624-4
Synonyms 6-(Ethoxycarbonyl)-(1S,2S)-1,2-dihydroxycyclohexa-3,5-diene (+)-Ethyl (5S,6R)-5,6-dihydroxycyclohexa-1,3-dienecarboxylate (5S,6R)-5,6-dihydroxy-1-cyclohexa-1,3-dienecarboxylic acid ethyl ester Ethyl (5S,6R)-5,6-dihydroxycyclohexa-1,3-diene-1-carboxylate Ethyl (5S,6R)-5,6-bis(oxidanyl)cyclohexa-1,3-diene-1-carboxylate (5S,6R)-ethyl 5,6-dihydroxycyclohexa-1,3-dienecarboxylate
Wiley ID 1696636