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2,5-Cyclohexadiene-1-carboxylic acid, 3,5-dimethoxy-1-(3-oxopentyl)-, methyl ester

View entire compound with spectra: 1 MS (GC)

2,5-Cyclohexadiene-1-carboxylic acid, 3,5-dimethoxy-1-(3-oxopentyl)-, methyl ester
SpectraBase Compound ID 6JW380voxTb
InChI InChI=1S/C15H22O5/c1-5-11(16)6-7-15(14(17)20-4)9-12(18-2)8-13(10-15)19-3/h9-10H,5-8H2,1-4H3
InChIKey ASQFQOGFHJJWKF-UHFFFAOYSA-N
Mol Weight 282.34 g/mol
Molecular Formula C15H22O5
Exact Mass 282.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lrojkia6YMO
Name 2,5-Cyclohexadiene-1-carboxylic acid, 3,5-dimethoxy-1-(3-oxopentyl)-, methyl ester
Alternate Name(s) 1,3-Dimethoxy-5-methoxycarbonyl-5-(3-oxo-pentyl)-cyclohexa-3,6-diene Methyl 3,5-dimethoxy-1-(3-oxopentyl)-2,5-cyclohexadiene-1-carboxylate
CAS Registry Number 108161-98-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O5
InChI InChI=1S/C15H22O5/c1-5-11(16)6-7-15(14(17)20-4)9-12(18-2)8-13(10-15)19-3/h9-10H,5-8H2,1-4H3
InChIKey ASQFQOGFHJJWKF-UHFFFAOYSA-N
Molecular Weight 282.336 g/mol
SMILES C1(C=C(OC)CC(=C1)OC)(C(=O)OC)CCC(=O)CC
SPLASH splash10-0udi-0920000000-a5a725af0fb2d154cc35
Source of Spectrum F-42-2890-37
Wiley ID 1285790