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Carbamic acid, [4-chloro-3-oxo-1-(phenylmethyl)butyl]-, phenylmethyl ester, (S)-
SpectraBase Compound ID ItmI7Tye1VE
InChI InChI=1S/C19H20ClNO3/c20-13-18(22)12-17(11-15-7-3-1-4-8-15)21-19(23)24-14-16-9-5-2-6-10-16/h1-10,17H,11-14H2,(H,21,23)/t17-/m0/s1
InChIKey MYFSYQCQPWKFQT-KRWDZBQOSA-N
Mol Weight 345.83 g/mol
Molecular Formula C19H20ClNO3
Exact Mass 345.113171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7FCGxmfwhyL
Name Carbamic acid, [4-chloro-3-oxo-1-(phenylmethyl)butyl]-, phenylmethyl ester, (S)-
Alternate Name(s) (S)-1-phenyl-2-benzyloxycarbonylamino-4-oxo-5-chloropentane benzyl (1S)-1-benzyl-4-chloro-3-oxobutylcarbamate
CAS Registry Number 65985-79-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20ClNO3
InChI InChI=1S/C19H20ClNO3/c20-13-18(22)12-17(11-15-7-3-1-4-8-15)21-19(23)24-14-16-9-5-2-6-10-16/h1-10,17H,11-14H2,(H,21,23)/t17-/m0/s1
InChIKey MYFSYQCQPWKFQT-KRWDZBQOSA-N
Molecular Weight 345.826 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@](CC(=O)CCl)(Cc1ccccc1)[H]
SPLASH splash10-0006-9010000000-9e7312749f519737570f
Source of Spectrum H-60-2754-0
Wiley ID 1338656