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(1RS,6RS)-5-oxo-N-((S)-1-phenylethyl)bicyclo[4.2.0]octrne-1-carboxamide
SpectraBase Compound ID 5K7SPNygpVN
InChI InChI=1S/C17H21NO2/c1-12(13-6-3-2-4-7-13)18-16(20)17-10-5-8-15(19)14(17)9-11-17/h2-4,6-7,12,14H,5,8-11H2,1H3,(H,18,20)/t12-,14?,17?/m0/s1
InChIKey IGCQADXNWBKINO-MKQDKFQKSA-N
Mol Weight 271.36 g/mol
Molecular Formula C17H21NO2
Exact Mass 271.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DiuOdYXwNbC
Name (1RS,6RS)-5-oxo-N-((S)-1-phenylethyl)bicyclo[4.2.0]octrne-1-carboxamide
Alternate Name(s) 5-Oxo-N-[(1S)-1-phenylethyl]bicyclo[4.2.0]octane-1-carboxamide
CAS Registry Number 105539-63-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO2
InChI InChI=1S/C17H21NO2/c1-12(13-6-3-2-4-7-13)18-16(20)17-10-5-8-15(19)14(17)9-11-17/h2-4,6-7,12,14H,5,8-11H2,1H3,(H,18,20)/t12-,14?,17?/m0/s1
InChIKey IGCQADXNWBKINO-MKQDKFQKSA-N
Molecular Weight 271.360 g/mol
SMILES N(C(C12C(C(=O)CCC2)CC1)=O)[C@](c1ccccc1)(C)[H]
SPLASH splash10-0a4i-3900000000-043ba545c23a2daea243
Source of Spectrum J-51-5229-10
Wiley ID 1275433