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2H-Azepin-2-one, hexahydro-3-(4-phenyl-3-butenyl)-, (Z)-
SpectraBase Compound ID CyjiPGamk4m
InChI InChI=1S/C16H21NO/c18-16-15(12-6-7-13-17-16)11-5-4-10-14-8-2-1-3-9-14/h1-4,8-10,15H,5-7,11-13H2,(H,17,18)/b10-4-
InChIKey KWCXPMJSRRPHQP-WMZJFQQLSA-N
Mol Weight 243.35 g/mol
Molecular Formula C16H21NO
Exact Mass 243.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDU1hFISn6q
Name 2H-Azepin-2-one, hexahydro-3-(4-phenyl-3-butenyl)-, (Z)-
Alternate Name(s) 3-((Z)-4-phenyl-3-butynyl)hexahydro-2H-azepin-2-one 3-[(3Z)-4-phenyl-3-butenyl]hexahydro-2H-azepin-2-one
CAS Registry Number 124943-58-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO
InChI InChI=1S/C16H21NO/c18-16-15(12-6-7-13-17-16)11-5-4-10-14-8-2-1-3-9-14/h1-4,8-10,15H,5-7,11-13H2,(H,17,18)/b10-4-
InChIKey KWCXPMJSRRPHQP-WMZJFQQLSA-N
Molecular Weight 243.350 g/mol
SMILES N1CCCCC(C1=O)CC\C=C/c1ccccc1
SPLASH splash10-03dj-0900000000-fe487f955f8f7d5806e2
Source of Spectrum J-55-1455-26
Wiley ID 1246254