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Heptadecyl 3-methylbutanoate

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Heptadecyl 3-methylbutanoate
SpectraBase Compound ID L4T48561yyr
InChI InChI=1S/C22H44O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-22(23)20-21(2)3/h21H,4-20H2,1-3H3
InChIKey PRIFMYWTZKZMDP-UHFFFAOYSA-N
Mol Weight 340.6 g/mol
Molecular Formula C22H44O2
Exact Mass 340.334131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID VFaZl769DR
Name Isovaleric acid, heptadecyl ester
Classification Fatty alcohol esters
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 340.334130655 u
Formula C22H44O2
InChI InChI=1S/C22H44O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-22(23)20-21(2)3/h21H,4-20H2,1-3H3
InChIKey PRIFMYWTZKZMDP-UHFFFAOYSA-N
Molecular Weight 340.592 g/mol
Number of Peaks 24
SMILES C(CC(C)C)(=O)OCCCCCCCCCCCCCCCCC
SPLASH splash10-0zfr-9500000000-1517a8ec3a74e6c5ba8c
Source of Spectrum FF-29-258-258_3 (DOI: 10.1002/ffj.3205)
Synonyms Heptadecyl 3-methylbutanoate 3-Methylbutanoic acid heptadecyl ester
Wiley ID 1775727