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Linalyl benzoate
SpectraBase Compound ID FXNfqYFBmUr
InChI InChI=1S/C17H22O2/c1-5-17(4,13-9-10-14(2)3)19-16(18)15-11-7-6-8-12-15/h5-8,10-12H,1,9,13H2,2-4H3
InChIKey BTJXBZZBBNNTOV-UHFFFAOYSA-N
Mol Weight 258.36 g/mol
Molecular Formula C17H22O2
Exact Mass 258.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JAneSgI9Czy
Name Linalyl benzoate
Alternate Name(s) (1,5-dimethyl-1-vinyl-hex-4-enyl) benzoate 3,7-Dimethylocta-1,6-dien-3-yl benzoate benzoic acid (1,5-dimethyl-1-vinyl-hex-4-enyl) ester benzoic acid 3,7-dimethylocta-1,6-dien-3-yl ester
CAS Registry Number 126-64-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O2
InChI InChI=1S/C17H22O2/c1-5-17(4,13-9-10-14(2)3)19-16(18)15-11-7-6-8-12-15/h5-8,10-12H,1,9,13H2,2-4H3
InChIKey BTJXBZZBBNNTOV-UHFFFAOYSA-N
Molecular Weight 258.361 g/mol
SMILES c1ccc(cc1)C(=O)OC(C=C)(C)CCC=C(C)C
SPLASH splash10-052f-9300000000-e97ccfdbda2daed7b02f
Source of Spectrum PR-1372-0-0
Wiley ID 240857