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benzoic acid, geranyl ester

View entire compound with spectra: 4 NMR, 4 FTIR, and 3 MS (GC)

benzoic acid, geranyl ester
SpectraBase Compound ID HHGyBq6hnln
InChI InChI=1S/C17H22O2/c1-14(2)8-7-9-15(3)12-13-19-17(18)16-10-5-4-6-11-16/h4-6,8,10-12H,7,9,13H2,1-3H3/b15-12+
InChIKey YDVXYTIIPGKIJP-NTCAYCPXSA-N
Mol Weight 258.36 g/mol
Molecular Formula C17H22O2
Exact Mass 258.16198 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 1piRLqAMqcQ
Name GERANYL BENZOATE
Source of Sample Givaudan Corporation, New York, New York
Boiling Point 198-200C/15 MM
CAS Registry Number 94-48-4
Comments Physical Description= SLIGHTLY YELLOWISH LIQUID
Compound Type Pure
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
FEMA Number 2511
Formula C17H22O2
InChI InChI=1S/C17H22O2/c1-14(2)8-7-9-15(3)12-13-19-17(18)16-10-5-4-6-11-16/h4-6,8,10-12H,7,9,13H2,1-3H3/b15-12+
InChIKey YDVXYTIIPGKIJP-NTCAYCPXSA-N
Molecular Weight 258.36
Optical Properties Index of Refraction= 1.513-1.581 (20C)
Sample Description FLORAL RESEMBLING YLANG YLANG OIL
Synonyms GERANIOL BENZOATE trans-3,7-DIMETHYL-2,6-OCTADIEN-1-YL BENZOATE trans-3,7-DIMETHYL-2,6-OCTADIEN-1-OL, BENZOATE
Technique CAPILLARY CELL: NEAT