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tert-Butyll 2(S)-1-(tert-butyloxycarbonyl)-4-beta.-(phenylmethyl)pyroglutamate
SpectraBase Compound ID LlMpb3ncRPu
InChI InChI=1S/C21H29NO5/c1-20(2,3)26-18(24)16-13-15(12-14-10-8-7-9-11-14)17(23)22(16)19(25)27-21(4,5)6/h7-11,15-16H,12-13H2,1-6H3/t15-,16+/m1/s1
InChIKey ZUHIBGSCWSJXGX-CVEARBPZSA-N
Mol Weight 375.47 g/mol
Molecular Formula C21H29NO5
Exact Mass 375.204573 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DRQNwJVWdBW
Name tert-Butyll 2(S)-1-(tert-butyloxycarbonyl)-4-beta.-(phenylmethyl)pyroglutamate
Alternate Name(s) di(tert-butyl) (2S,4R)-4-benzyl-5-oxo-1,2-pyrrolidinedicarboxylate (2S,4R)-5-oxo-4-(phenylmethyl)pyrrolidine-1,2-dicarboxylic acid ditert-butyl ester ditert-butyl (2S,4R)-4-benzyl-5-oxopyrrolidine-1,2-dicarboxylate ditert-butyl (2S,4R)-4-benzyl-5-oxo-pyrrolidine-1,2-dicarboxylate ditert-butyl (2S,4R)-5-oxidanylidene-4-(phenylmethyl)pyrrolidine-1,2-dicarboxylate
CAS Registry Number 138858-47-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO5
InChI InChI=1S/C21H29NO5/c1-20(2,3)26-18(24)16-13-15(12-14-10-8-7-9-11-14)17(23)22(16)19(25)27-21(4,5)6/h7-11,15-16H,12-13H2,1-6H3/t15-,16+/m1/s1
InChIKey ZUHIBGSCWSJXGX-CVEARBPZSA-N
Molecular Weight 375.465 g/mol
SMILES C(N1[C@](C(OC(C)(C)C)=O)(C[C@](C1=O)(Cc1ccccc1)[H])[H])(OC(C)(C)C)=O
SPLASH splash10-01bc-7269000000-5caf0d6c06b7fbb79dfe
Source of Spectrum J-57-1924-9
Wiley ID 1357229