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(2S)-Benzyloxycarbonylamino-5-(1-uracilyl)pentanoic acid
SpectraBase Compound ID 4MizOXggajT
InChI InChI=1S/C17H19N3O6/c21-14-8-10-20(16(24)19-14)9-4-7-13(15(22)23)18-17(25)26-11-12-5-2-1-3-6-12/h1-3,5-6,8,10,13H,4,7,9,11H2,(H,18,25)(H,22,23)(H,19,21,24)/t13-/m0/s1
InChIKey ROZVHEFNUFRCTI-ZDUSSCGKSA-N
Mol Weight 361.35 g/mol
Molecular Formula C17H19N3O6
Exact Mass 361.127385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LVj67mA8Urc
Name (2S)-Benzyloxycarbonylamino-5-(1-uracilyl)pentanoic acid
Alternate Name(s) (2S)-2-{[(benzyloxy)carbonyl]amino}-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)pentanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19N3O6
InChI InChI=1S/C17H19N3O6/c21-14-8-10-20(16(24)19-14)9-4-7-13(15(22)23)18-17(25)26-11-12-5-2-1-3-6-12/h1-3,5-6,8,10,13H,4,7,9,11H2,(H,18,25)(H,22,23)(H,19,21,24)/t13-/m0/s1
InChIKey ROZVHEFNUFRCTI-ZDUSSCGKSA-N
Molecular Weight 361.354 g/mol
SMILES N1C(C=CN(CCC[C@@](C(=O)O)(NC(=O)OCc2ccccc2)[H])C1=O)=O
SPLASH splash10-03di-0009000000-16b2da4f27945d432160
Source of Spectrum KC-57-6551-27
Wiley ID 1625243