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1-Benzylbutyl acetate

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

1-Benzylbutyl acetate
SpectraBase Compound ID 6pSN0qoktAA
InChI InChI=1S/C13H18O2/c1-3-7-13(15-11(2)14)10-12-8-5-4-6-9-12/h4-6,8-9,13H,3,7,10H2,1-2H3
InChIKey SQDNMNGMXDLRIE-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IPWGm1lTBUV
Name 1-Benzylbutyl acetate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-3-7-13(15-11(2)14)10-12-8-5-4-6-9-12/h4-6,8-9,13H,3,7,10H2,1-2H3
InChIKey SQDNMNGMXDLRIE-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
SMILES C(C)(=O)OC(CCC)Cc1ccccc1
SPLASH splash10-00ke-3910000000-903f6e6909adc5b9bef5
Source of Spectrum SO-0-70-4
Synonyms Acetic acid 1-phenylpentan-2-yl ester 1-Phenylpentan-2-yl acetate 1-Phenylpentan-2-yl ethanoate
Wiley ID 1541919