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5-Oxidanylidenepentyl benzoate
SpectraBase Compound ID HVxqUnhyHYr
InChI InChI=1S/C12H14O3/c13-9-5-2-6-10-15-12(14)11-7-3-1-4-8-11/h1,3-4,7-9H,2,5-6,10H2
InChIKey GVMCAESDBLOXND-UHFFFAOYSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7YfjJm3RgA9
Name 5-Oxidanylidenepentyl benzoate
Alternate Name(s) Pentanal, 5-(benzoyloxy)- 5-Oxopentyl benzoate benzoic acid 5-ketopentyl ester benzoic acid 5-oxopentyl ester
CAS Registry Number 55162-83-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3
InChI InChI=1S/C12H14O3/c13-9-5-2-6-10-15-12(14)11-7-3-1-4-8-11/h1,3-4,7-9H,2,5-6,10H2
InChIKey GVMCAESDBLOXND-UHFFFAOYSA-N
Molecular Weight 206.241 g/mol
SMILES c1ccc(cc1)C(=O)OCCCCC=O
SPLASH splash10-0a4i-7900000000-dbcd50096d212f0332de
Source of Spectrum SD-1981-0-0
Wiley ID 1204353