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(S)-2-Benzyloxycarbonylamino-4-oxo-4-phenylbutanoyl azetidine
SpectraBase Compound ID Ef4SPPi6wEu
InChI InChI=1S/C21H22N2O4/c24-19(17-10-5-2-6-11-17)14-18(20(25)23-12-7-13-23)22-21(26)27-15-16-8-3-1-4-9-16/h1-6,8-11,18H,7,12-15H2,(H,22,26)/t18-/m0/s1
InChIKey WKBMWJOYQPFPPO-SFHVURJKSA-N
Mol Weight 366.42 g/mol
Molecular Formula C21H22N2O4
Exact Mass 366.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D3RYbOfyQbp
Name (S)-2-Benzyloxycarbonylamino-4-oxo-4-phenylbutanoyl azetidine
Alternate Name(s) benzyl (1S)-1-(1-azetidinylcarbonyl)-3-oxo-3-phenylpropylcarbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N2O4
InChI InChI=1S/C21H22N2O4/c24-19(17-10-5-2-6-11-17)14-18(20(25)23-12-7-13-23)22-21(26)27-15-16-8-3-1-4-9-16/h1-6,8-11,18H,7,12-15H2,(H,22,26)/t18-/m0/s1
InChIKey WKBMWJOYQPFPPO-SFHVURJKSA-N
Molecular Weight 366.417 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@](C(N1CCC1)=O)(CC(=O)c1ccccc1)[H]
SPLASH splash10-052f-9400000000-3b2aaf33699a79e5e354
Source of Spectrum QC-9-4466-5
Wiley ID 870954