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Ethyl 2-{[2-(Benzyloxy)-4-methylphenyl]carbonyl}-5-methyl-2-(3-methylbut-2-en-1-yl)hex-4-enoate
SpectraBase Compound ID 8R49sP0RXTQ
InChI InChI=1S/C29H36O4/c1-7-32-28(31)29(17-15-21(2)3,18-16-22(4)5)27(30)25-14-13-23(6)19-26(25)33-20-24-11-9-8-10-12-24/h8-16,19H,7,17-18,20H2,1-6H3
InChIKey MSGXGUJXRWNKIW-UHFFFAOYSA-N
Mol Weight 448.6 g/mol
Molecular Formula C29H36O4
Exact Mass 448.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5onmbbosxF
Name Ethyl 2-{[2-(Benzyloxy)-4-methylphenyl]carbonyl}-5-methyl-2-(3-methylbut-2-en-1-yl)hex-4-enoate
Alternate Name(s) Ethyl 2-(2-(benzyloxy)-4-methylbenzoyl)-5-methyl-2-(3-methylbut-2-en-1-yl)hex-4-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H36O4
InChI InChI=1S/C29H36O4/c1-7-32-28(31)29(17-15-21(2)3,18-16-22(4)5)27(30)25-14-13-23(6)19-26(25)33-20-24-11-9-8-10-12-24/h8-16,19H,7,17-18,20H2,1-6H3
InChIKey MSGXGUJXRWNKIW-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201000111
Molecular Weight 448.603 g/mol
SMILES C(C(OCC)=O)(CC=C(C)C)(C(c1ccc(cc1OCc1ccccc1)C)=O)CC=C(C)C
SPLASH splash10-000b-1900000000-73c40a9aed5da79bdc72
Source of Spectrum H-93-1268-12b
Wiley ID 1784018