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Methyl 2-(methoxycarbonyl)-3-methyl-7-phenylhept-4-enoate
SpectraBase Compound ID KCYGdyZ3nXJ
InChI InChI=1S/C17H22O4/c1-13(15(16(18)20-2)17(19)21-3)9-7-8-12-14-10-5-4-6-11-14/h4-7,9-11,13,15H,8,12H2,1-3H3/b9-7+
InChIKey WJBUPHKVQQNWSK-VQHVLOKHSA-N
Mol Weight 290.36 g/mol
Molecular Formula C17H22O4
Exact Mass 290.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7PclVlusVtN
Name Methyl 2-(methoxycarbonyl)-3-methyl-7-phenylhept-4-enoate
Alternate Name(s) Dimethyl 2-[(2E)-1-methyl-5-phenyl-2-pentenyl]malonate
CAS Registry Number 103240-59-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O4
InChI InChI=1S/C17H22O4/c1-13(15(16(18)20-2)17(19)21-3)9-7-8-12-14-10-5-4-6-11-14/h4-7,9-11,13,15H,8,12H2,1-3H3/b9-7+
InChIKey WJBUPHKVQQNWSK-VQHVLOKHSA-N
Molecular Weight 290.359 g/mol
SMILES C(C(=O)OC)(C(=O)OC)C(\C=C\CCc1ccccc1)C
SPLASH splash10-054o-9100000000-dfc9dadd2d01fa335dec
Source of Spectrum J-51-4014-12
Wiley ID 1293726