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Benzamide, N-[2-(1-cyclohepten-1-yl)cycloheptyl]-, trans-
SpectraBase Compound ID CjrXiIVhKB3
InChI InChI=1S/C21H29NO/c23-21(18-13-7-3-8-14-18)22-20-16-10-4-9-15-19(20)17-11-5-1-2-6-12-17/h3,7-8,11,13-14,19-20H,1-2,4-6,9-10,12,15-16H2,(H,22,23)/t19-,20+/m0/s1
InChIKey LETUOBBRAHJTTM-VQTJNVASSA-N
Mol Weight 311.47 g/mol
Molecular Formula C21H29NO
Exact Mass 311.224915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AmMXFVFjgfF
Name Benzamide, N-[2-(1-cyclohepten-1-yl)cycloheptyl]-, trans-
Alternate Name(s) N-[(1R,2S)-2-(1-cyclohepten-1-yl)cycloheptyl]benzamide trans-1-benzamido-2-cyclohepten-1-ylcycloheptane
CAS Registry Number 117720-89-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO
InChI InChI=1S/C21H29NO/c23-21(18-13-7-3-8-14-18)22-20-16-10-4-9-15-19(20)17-11-5-1-2-6-12-17/h3,7-8,11,13-14,19-20H,1-2,4-6,9-10,12,15-16H2,(H,22,23)/t19-,20+/m0/s1
InChIKey LETUOBBRAHJTTM-VQTJNVASSA-N
Molecular Weight 311.469 g/mol
SMILES N(C(=O)c1ccccc1)[C@]1([C@](C2=CCCCCC2)(CCCCC1)[H])[H]
SPLASH splash10-0a4i-0921000000-1f76ff1c291cd19c55af
Source of Spectrum F-44-1968-19
Wiley ID 1312716