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4-carbomethoxy-3-methoxy-4-(trans-3'-pentenyl)-2,5-cyclohexadien-1-one
SpectraBase Compound ID 8I2ID01fmvS
InChI InChI=1S/C14H18O4/c1-4-5-6-8-14(13(16)18-3)9-7-11(15)10-12(14)17-2/h4-5,7,9-10H,6,8H2,1-3H3/b5-4+
InChIKey CWJBPNJGMKPBGL-SNAWJCMRSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jbj0Irdh2xi
Name 4-carbomethoxy-3-methoxy-4-(trans-3'-pentenyl)-2,5-cyclohexadien-1-one
Alternate Name(s) Methyl 2-methoxy-4-oxo-1-[(3E)-3-pentenyl]-2,5-cyclohexadiene-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-4-5-6-8-14(13(16)18-3)9-7-11(15)10-12(14)17-2/h4-5,7,9-10H,6,8H2,1-3H3/b5-4+
InChIKey CWJBPNJGMKPBGL-SNAWJCMRSA-N
Molecular Weight 250.294 g/mol
SMILES C1(C(=CC(C=C1)=O)OC)(C(=O)OC)CC\C=C\C
SPLASH splash10-0ue9-0900000000-2418df60e4f4d7e26a51
Source of Spectrum C-110-5543-26
Wiley ID 1253319