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1-Phenylazepane

View entire compound with spectra: 1 MS (GC)

1-Phenylazepane
SpectraBase Compound ID 6mtRSeBLYJL
InChI InChI=1S/C12H17N/c1-2-7-11-13(10-6-1)12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11H2
InChIKey YMDZJGQBSPNMEF-UHFFFAOYSA-N
Mol Weight 175.27 g/mol
Molecular Formula C12H17N
Exact Mass 175.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ABTdUakDsoz
Name 1-Phenylazepane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17N
InChI InChI=1S/C12H17N/c1-2-7-11-13(10-6-1)12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11H2
InChIKey YMDZJGQBSPNMEF-UHFFFAOYSA-N
Instrument Name Shimadzu-QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/cctc.202000881
Molecular Weight 175.275 g/mol
SMILES c1cc(ccc1)N1CCCCCC1
SPLASH splash10-004j-4900000000-9c16e7790ae5913c434f
Source of Spectrum CCC-12-SM18-9h
Wiley ID 1856125