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Methyl 4-(2-methyl-1-propyl)-3-oxo-6-phenylhexanoate
SpectraBase Compound ID 7ZqFkA0cDQh
InChI InChI=1S/C17H24O3/c1-13(2)11-15(16(18)12-17(19)20-3)10-9-14-7-5-4-6-8-14/h4-8,13,15H,9-12H2,1-3H3
InChIKey YURDYONIBFJVAR-UHFFFAOYSA-N
Mol Weight 276.38 g/mol
Molecular Formula C17H24O3
Exact Mass 276.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1W4rz7lfMNH
Name Methyl 4-(2-methyl-1-propyl)-3-oxo-6-phenylhexanoate
Alternate Name(s) Methyl 6-methyl-3-oxo-4-(2-phenylethyl)heptanoate
CAS Registry Number 104620-22-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O3
InChI InChI=1S/C17H24O3/c1-13(2)11-15(16(18)12-17(19)20-3)10-9-14-7-5-4-6-8-14/h4-8,13,15H,9-12H2,1-3H3
InChIKey YURDYONIBFJVAR-UHFFFAOYSA-N
Molecular Weight 276.376 g/mol
SMILES C(C(C(CC(C)C)CCc1ccccc1)=O)C(=O)OC
SPLASH splash10-004i-0920000000-01b66789427adf5f072a
Source of Spectrum C-108-7690-9
Wiley ID 1280323