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1-(2-carbomethoxy-3-methoxy-benzyl)-2,5-dimethoxy-cyclohexa-2,5-diene-1-carboxylic acid
SpectraBase Compound ID ETpWzxvIiyG
InChI InChI=1S/C19H22O7/c1-23-13-8-9-15(25-3)19(11-13,18(21)22)10-12-6-5-7-14(24-2)16(12)17(20)26-4/h5-7,9,11H,8,10H2,1-4H3,(H,21,22)
InChIKey FQIZSEFNUTXTQA-UHFFFAOYSA-N
Mol Weight 362.38 g/mol
Molecular Formula C19H22O7
Exact Mass 362.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9FO8b6fMCH5
Name 1-(2-carbomethoxy-3-methoxy-benzyl)-2,5-dimethoxy-cyclohexa-2,5-diene-1-carboxylic acid
CAS Registry Number 91127-19-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O7
InChI InChI=1S/C19H22O7/c1-23-13-8-9-15(25-3)19(11-13,18(21)22)10-12-6-5-7-14(24-2)16(12)17(20)26-4/h5-7,9,11H,8,10H2,1-4H3,(H,21,22)
InChIKey FQIZSEFNUTXTQA-UHFFFAOYSA-N
Molecular Weight 362.378 g/mol
SMILES OC(C1(Cc2c(C(=O)OC)c(OC)ccc2)C(=CCC(=C1)OC)OC)=O
SPLASH splash10-00m1-0922000000-f1d4934f3b94ceaed3f7
Source of Spectrum J-49-3255-0
Synonyms 2,5-Dimethoxy-1-[(3-methoxy-2-methoxycarbonyl-phenyl)methyl]cyclohexa-2,5-diene-1-carboxylic acid 2,5-Dimethoxy-1-[(3-methoxy-2-methoxycarbonylphenyl)methyl]-1-cyclohexa-2,5-dienecarboxylic acid
Wiley ID 1349495