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cis-4-(benzoylamino)cycloheptanol

View entire compound with spectra: 2 MS (GC)

cis-4-(benzoylamino)cycloheptanol
SpectraBase Compound ID EhlQGEBLIfN
InChI InChI=1S/C14H19NO2/c16-13-8-4-7-12(9-10-13)15-14(17)11-5-2-1-3-6-11/h1-3,5-6,12-13,16H,4,7-10H2,(H,15,17)/t12-,13+/m0/s1
InChIKey WHXLDNCBUPIYHF-QWHCGFSZSA-N
Mol Weight 233.31 g/mol
Molecular Formula C14H19NO2
Exact Mass 233.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6rMeLcBvfRA
Name cis-4-(benzoylamino)cycloheptanol
Alternate Name(s) N-[(1S,4R)-4-hydroxycycloheptyl]benzamide
CAS Registry Number 95687-91-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19NO2
InChI InChI=1S/C14H19NO2/c16-13-8-4-7-12(9-10-13)15-14(17)11-5-2-1-3-6-11/h1-3,5-6,12-13,16H,4,7-10H2,(H,15,17)/t12-,13+/m0/s1
InChIKey WHXLDNCBUPIYHF-QWHCGFSZSA-N
Molecular Weight 233.311 g/mol
SMILES N(C(=O)c1ccccc1)[C@@]1(CC[C@@](CCC1)(O)[H])[H]
SPLASH splash10-05fr-0910000000-04bca7b93a69f3aac5ed
Source of Spectrum J-50-1822-0
Wiley ID 1235015