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(S)-3-Benzyloxepan-2-one

View entire compound with spectra: 1 MS (GC)

(S)-3-Benzyloxepan-2-one
SpectraBase Compound ID KDrG3Aw1R7G
InChI InChI=1S/C13H16O2/c14-13-12(8-4-5-9-15-13)10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2/t12-/m0/s1
InChIKey JEHNLMDRQXUAOQ-LBPRGKRZSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID jgoXXcM5Jt
Name (S)-3-Benzyloxepan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c14-13-12(8-4-5-9-15-13)10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2/t12-/m0/s1
InChIKey JEHNLMDRQXUAOQ-LBPRGKRZSA-N
Molecular Weight 204.269 g/mol
SMILES C1(OCCCC[C@]1(Cc1ccccc1)[H])=O
SPLASH splash10-0f6y-7940000000-4aaf444616a0ddf9b0eb
Source of Spectrum SO-0-950-4
Synonyms (3S)-3-benzyl-2-oxepanone
Wiley ID 1545841