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1H-Azepine-1-carboxaldehyde, hexahydro-2-phenyl-
SpectraBase Compound ID EtIKkLCmnMt
InChI InChI=1S/C13H17NO/c15-11-14-10-6-2-5-9-13(14)12-7-3-1-4-8-12/h1,3-4,7-8,11,13H,2,5-6,9-10H2
InChIKey HUIYGUCNCWYBNY-UHFFFAOYSA-N
Mol Weight 203.28 g/mol
Molecular Formula C13H17NO
Exact Mass 203.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5y4jNtqIYTD
Name 1H-Azepine-1-carboxaldehyde, hexahydro-2-phenyl-
Alternate Name(s) 2-phenyl-1-azepanecarboxaldehyde 2-phenylazepane-1-carbaldehyde
CAS Registry Number 71602-41-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO
InChI InChI=1S/C13H17NO/c15-11-14-10-6-2-5-9-13(14)12-7-3-1-4-8-12/h1,3-4,7-8,11,13H,2,5-6,9-10H2
InChIKey HUIYGUCNCWYBNY-UHFFFAOYSA-N
Molecular Weight 203.285 g/mol
SMILES C1(N(CCCCC1)C=O)c1ccccc1
SPLASH splash10-0udi-0090000000-0a5588d5196def49e835
Source of Spectrum SB-35-415-0
Wiley ID 1200987