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[1-(4-methoxy-3,6-dioxo-cyclohexa-1,4-dien-1-yl)cyclopentyl]methyl benzoate
SpectraBase Compound ID C9Uv9DQI7fN
InChI InChI=1S/C20H20O5/c1-24-18-12-16(21)15(11-17(18)22)20(9-5-6-10-20)13-25-19(23)14-7-3-2-4-8-14/h2-4,7-8,11-12H,5-6,9-10,13H2,1H3
InChIKey XXZLMQZLNXIRJY-UHFFFAOYSA-N
Mol Weight 340.38 g/mol
Molecular Formula C20H20O5
Exact Mass 340.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZCECrQ7U1j
Name [1-(4-methoxy-3,6-dioxo-cyclohexa-1,4-dien-1-yl)cyclopentyl]methyl benzoate
CAS Registry Number 88346-36-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O5
InChI InChI=1S/C20H20O5/c1-24-18-12-16(21)15(11-17(18)22)20(9-5-6-10-20)13-25-19(23)14-7-3-2-4-8-14/h2-4,7-8,11-12H,5-6,9-10,13H2,1H3
InChIKey XXZLMQZLNXIRJY-UHFFFAOYSA-N
Molecular Weight 340.375 g/mol
SMILES C1(=CC(=O)C(=CC1=O)OC)C1(COC(=O)c2ccccc2)CCCC1
SPLASH splash10-0a6r-9712000000-06ee37f91f9fde610cdb
Source of Spectrum Y-20-1269-0
Synonyms [1-[4-methoxy-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]cyclopentyl]methyl benzoate benzoic acid [1-(4-methoxy-3,6-dioxo-1-cyclohexa-1,4-dienyl)cyclopentyl]methyl ester [1-(4-methoxy-3,6-dioxocyclohexa-1,4-dien-1-yl)cyclopentyl]methyl benzoate
Wiley ID 1335228