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4-Phenyl-2,3,4,5-tetrahydrooxepine

View entire compound with spectra: 1 MS (GC)

4-Phenyl-2,3,4,5-tetrahydrooxepine
SpectraBase Compound ID 3fAcaXg58wG
InChI InChI=1S/C12H14O/c1-2-5-11(6-3-1)12-7-4-9-13-10-8-12/h1-6,9,12H,7-8,10H2
InChIKey WSAKCXQOCZEFMR-UHFFFAOYSA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11nt5iYQKUQ
Name 4-Phenyl-2,3,4,5-tetrahydrooxepine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O
InChI InChI=1S/C12H14O/c1-2-5-11(6-3-1)12-7-4-9-13-10-8-12/h1-6,9,12H,7-8,10H2
InChIKey WSAKCXQOCZEFMR-UHFFFAOYSA-N
Molecular Weight 174.243 g/mol
SMILES C=1OCCC(CC1)c1ccccc1
SPLASH splash10-0002-9100000000-04beaaf0bdbb388d4bdd
Source of Spectrum C5-2003-592-51
Synonyms 4-phenyl-2,3,4,5-tetrahydrooxepin
Wiley ID 1615518