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Pentadecyl 2-methylbutanoate

View entire compound with spectra: 1 NMR, and 2 MS (GC)

Pentadecyl 2-methylbutanoate
SpectraBase Compound ID HvTlxbgMZMS
InChI InChI=1S/C20H40O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-22-20(21)19(3)5-2/h19H,4-18H2,1-3H3
InChIKey VAIFMEXPRDBBKM-UHFFFAOYSA-N
Mol Weight 312.5 g/mol
Molecular Formula C20H40O2
Exact Mass 312.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A0nuSsrRBFY
Name Pentadecyl 2-methylbutanoate
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 312.302830526 u
Formula C20H40O2
InChI InChI=1S/C20H40O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-22-20(21)19(3)5-2/h19H,4-18H2,1-3H3
InChIKey VAIFMEXPRDBBKM-UHFFFAOYSA-N
Molecular Weight 312.538 g/mol
Number of Peaks 19
SMILES C(C(CC)C)(=O)OCCCCCCCCCCCCCCC
SPLASH splash10-0zfr-9600000000-2994ea5cae16ecd46737
Source of Spectrum FF-29-257-257_6 (DOI: 10.1002/ffj.3205)
Wiley ID 1775721