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Neryl isobutanoate
SpectraBase Compound ID F2bxIWs6UMf
InChI InChI=1S/C14H24O2/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h7,9,12H,6,8,10H2,1-5H3/b13-9-
InChIKey OGJYXQFXLSCKTP-LCYFTJDESA-N
Mol Weight 224.34 g/mol
Molecular Formula C14H24O2
Exact Mass 224.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 35Jac6oaJxy
Name Neryl isobutanoate
CAS Registry Number 2345-24-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C14H24O2/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h7,9,12H,6,8,10H2,1-5H3/b13-9-
InChIKey OGJYXQFXLSCKTP-LCYFTJDESA-N
Molecular Weight 224.344 g/mol
SMILES C(C(C)C)(=O)OC\C=C/(CCC=C(C)C)C
SPLASH splash10-00kf-9000000000-334458de4809540fde7a
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887683