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4-Benzoxyhexan-3-one

View entire compound with spectra: 1 MS (GC)

4-Benzoxyhexan-3-one
SpectraBase Compound ID BeoU4P8SXNC
InChI InChI=1S/C13H18O2/c1-3-12(14)13(4-2)15-10-11-8-6-5-7-9-11/h5-9,13H,3-4,10H2,1-2H3
InChIKey BNMINPKOBDOFOF-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 7mUuD1WNkcv
Name 4-Benzoxyhexan-3-one
Alternate Name(s) 4-Benzyloxyhexan-3-one 4-Phenylmethoxy-3-hexanone 4-Phenylmethoxyhexan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-3-12(14)13(4-2)15-10-11-8-6-5-7-9-11/h5-9,13H,3-4,10H2,1-2H3
InChIKey BNMINPKOBDOFOF-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
SMILES CCC(C(CC)OCc1ccccc1)=O
SPLASH splash10-0k97-9600000000-8eaf9dcedd107489f550
Source of Spectrum AJ-77-2055-14
Wiley ID 1577453