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Methyl 3-(4-methoxyphenyl)-2,6,6-trimethyl-5-oxoheptanoate
SpectraBase Compound ID 23klCrU2SWs
InChI InChI=1S/C18H26O4/c1-12(17(20)22-6)15(11-16(19)18(2,3)4)13-7-9-14(21-5)10-8-13/h7-10,12,15H,11H2,1-6H3
InChIKey SCVGINHYGZCXQE-UHFFFAOYSA-N
Mol Weight 306.4 g/mol
Molecular Formula C18H26O4
Exact Mass 306.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KBONOtoGT8Y
Name Methyl 3-(4-methoxyphenyl)-2,6,6-trimethyl-5-oxoheptanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O4
InChI InChI=1S/C18H26O4/c1-12(17(20)22-6)15(11-16(19)18(2,3)4)13-7-9-14(21-5)10-8-13/h7-10,12,15H,11H2,1-6H3
InChIKey SCVGINHYGZCXQE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200700600
Molecular Weight 306.402 g/mol
SMILES c1cc(C(CC(C(C)(C)C)=O)C(C(OC)=O)C)ccc1OC
SPLASH splash10-0a4r-9212000000-0d15d69f92b2fa1b14e2
Source of Spectrum ASC-350-1125/SM6-29
Wiley ID 1766189