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5-Chloro-2-(2-phenylethyl)-2,3,4,5,6,7-hexahydrooxepin

View entire compound with spectra: 1 MS (GC)

5-Chloro-2-(2-phenylethyl)-2,3,4,5,6,7-hexahydrooxepin
SpectraBase Compound ID 7DFpMTuZTM4
InChI InChI=1S/C14H19ClO/c15-13-7-9-14(16-11-10-13)8-6-12-4-2-1-3-5-12/h1-5,13-14H,6-11H2
InChIKey NLRNOIJFBHQUSX-UHFFFAOYSA-N
Mol Weight 238.76 g/mol
Molecular Formula C14H19ClO
Exact Mass 238.112443 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KlTMGy7SNja
Name 5-Chloro-2-(2-phenylethyl)-2,3,4,5,6,7-hexahydrooxepin
Alternate Name(s) 5-Chloro-2-(2-phenylethyl)oxepane
CAS Registry Number 123185-99-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19ClO
InChI InChI=1S/C14H19ClO/c15-13-7-9-14(16-11-10-13)8-6-12-4-2-1-3-5-12/h1-5,13-14H,6-11H2
InChIKey NLRNOIJFBHQUSX-UHFFFAOYSA-N
Molecular Weight 238.758 g/mol
SMILES C1(OCCC(CC1)Cl)CCc1ccccc1
SPLASH splash10-0006-9800000000-d7632793d7789853bc1f
Source of Spectrum J-54-5703-4
Wiley ID 1240711