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Methyl 3-keto-16-methylheptadecanoate
SpectraBase Compound ID 1Gyg7SQ38bm
InChI InChI=1S/C19H36O3/c1-17(2)14-12-10-8-6-4-5-7-9-11-13-15-18(20)16-19(21)22-3/h17H,4-16H2,1-3H3
InChIKey XNABBESUEGYCOT-UHFFFAOYSA-N
Mol Weight 312.5 g/mol
Molecular Formula C19H36O3
Exact Mass 312.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zCec6OGn2
Name Methyl 3-keto-16-methylheptadecanoate
Alternate Name(s) Methyl 16-methyl-3-oxoheptadecanoate
CAS Registry Number 87538-95-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H36O3
InChI InChI=1S/C19H36O3/c1-17(2)14-12-10-8-6-4-5-7-9-11-13-15-18(20)16-19(21)22-3/h17H,4-16H2,1-3H3
InChIKey XNABBESUEGYCOT-UHFFFAOYSA-N
Molecular Weight 312.494 g/mol
SMILES C(C(=O)OC)C(=O)CCCCCCCCCCCCC(C)C
SPLASH splash10-0i2a-3932000000-15b6d5881f2530ff543b
Source of Spectrum W5-1989-32909-32627
Wiley ID 1313647