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(2E,7Z)-15-(2-hydroxy-3,6-diketo-5-methoxy-cyclohexa-1,4-dien-1-yl)pentadeca-2,7-dienoic acid
SpectraBase Compound ID 3lt3rXaUu6F
InChI InChI=1S/C22H30O6/c1-28-19-16-18(23)21(26)17(22(19)27)14-12-10-8-6-4-2-3-5-7-9-11-13-15-20(24)25/h3,5,13,15-16,26H,2,4,6-12,14H2,1H3,(H,24,25)/b5-3-,15-13+
InChIKey DSDOWUKLOBXSHI-QQPYNVQXSA-N
Mol Weight 390.48 g/mol
Molecular Formula C22H30O6
Exact Mass 390.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jMc3iu2Jax
Name (2E,7Z)-15-(2-hydroxy-3,6-diketo-5-methoxy-cyclohexa-1,4-dien-1-yl)pentadeca-2,7-dienoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O6
InChI InChI=1S/C22H30O6/c1-28-19-16-18(23)21(26)17(22(19)27)14-12-10-8-6-4-2-3-5-7-9-11-13-15-20(24)25/h3,5,13,15-16,26H,2,4,6-12,14H2,1H3,(H,24,25)/b5-3-,15-13+
InChIKey DSDOWUKLOBXSHI-QQPYNVQXSA-N
Molecular Weight 390.476 g/mol
SMILES OC1=C(CCCCCCC\C=C/CCC\C=C\C(=O)O)C(C(=CC1=O)OC)=O
SPLASH splash10-014i-3903000000-69927969c3083d93ec2a
Source of Spectrum U-1997-315-2
Synonyms (2E,7Z)-15-(2-hydroxy-5-methoxy-3,6-dioxo-1-cyclohexa-1,4-dienyl)pentadeca-2,7-dienoic acid (2E,7Z)-15-(2-hydroxy-5-methoxy-3,6-dioxo-cyclohexa-1,4-dien-1-yl)pentadeca-2,7-dienoic acid (2E,7Z)-15-[5-methoxy-2-oxidanyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]pentadeca-2,7-dienoic acid
Wiley ID 769300