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Benzyl 2(S)-[(tert-butoxycarbonyl)amino]-4-oxo-5-chloropentanoate
SpectraBase Compound ID CogwpqAmyC4
InChI InChI=1S/C17H22ClNO5/c1-17(2,3)24-16(22)19-14(9-13(20)10-18)15(21)23-11-12-7-5-4-6-8-12/h4-8,14H,9-11H2,1-3H3,(H,19,22)/t14-/m0/s1
InChIKey CMHQCVUMIOQQRI-AWEZNQCLSA-N
Mol Weight 355.82 g/mol
Molecular Formula C17H22ClNO5
Exact Mass 355.118651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2bn401Af2jS
Name Benzyl 2(S)-[(tert-butoxycarbonyl)amino]-4-oxo-5-chloropentanoate
Alternate Name(s) benzyl (2S)-2-[(tert-butoxycarbonyl)amino]-5-chloro-4-oxopentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22ClNO5
InChI InChI=1S/C17H22ClNO5/c1-17(2,3)24-16(22)19-14(9-13(20)10-18)15(21)23-11-12-7-5-4-6-8-12/h4-8,14H,9-11H2,1-3H3,(H,19,22)/t14-/m0/s1
InChIKey CMHQCVUMIOQQRI-AWEZNQCLSA-N
Molecular Weight 355.818 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C(OCc1ccccc1)=O)(CC(=O)CCl)[H]
SPLASH splash10-0zfr-0069000000-91c2f6f1341c2a389abc
Source of Spectrum J-57-3403-17
Wiley ID 1345165