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Linalyl hexanoate
SpectraBase Compound ID BG6xj1ea2WF
InChI InChI=1S/C16H28O2/c1-6-8-9-12-15(17)18-16(5,7-2)13-10-11-14(3)4/h7,11H,2,6,8-10,12-13H2,1,3-5H3
InChIKey ALKCLFLTXBBMMP-UHFFFAOYSA-N
Mol Weight 252.4 g/mol
Molecular Formula C16H28O2
Exact Mass 252.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CPeutbSWEWM
Name Linalyl hexanoate
CAS Registry Number 7779-23-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O2
InChI InChI=1S/C16H28O2/c1-6-8-9-12-15(17)18-16(5,7-2)13-10-11-14(3)4/h7,11H,2,6,8-10,12-13H2,1,3-5H3
InChIKey ALKCLFLTXBBMMP-UHFFFAOYSA-N
Molecular Weight 252.398 g/mol
SMILES C(OC(C=C)(CCC=C(C)C)C)(=O)CCCCC
SPLASH splash10-000x-9100000000-e5299b3e5dab8b08c4c4
Source of Spectrum LQ-1992-1466-0
Synonyms (1,5-dimethyl-1-vinyl-hex-4-enyl) hexanoate 1,5-Dimethyl-1-vinyl-4-hexenyl hexanoate 3,7-Dimethylocta-1,6-dien-3-yl hexanoate Hexanoic acid (1,5-dimethyl-1-vinyl-hex-4-enyl) ester Hexanoic acid 3,7-dimethylocta-1,6-dien-3-yl ester Hexanoic acid, 1-ethenyl-1,5-dimethyl-4-hexenyl ester Linalyl n-hexanoate
Wiley ID 1256145