For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzyl-[(R)-2-(tert-Butoxycarbonylamino)-2-methyl-3-phenylpropanoyl]-L-alaninate
SpectraBase Compound ID 8BVH1wO6T5J
InChI InChI=1S/C25H32N2O5/c1-18(21(28)31-17-20-14-10-7-11-15-20)26-22(29)25(5,16-19-12-8-6-9-13-19)27-23(30)32-24(2,3)4/h6-15,18H,16-17H2,1-5H3,(H,26,29)(H,27,30)/t18-,25+/m0/s1
InChIKey IAIXGHVBGAFHTQ-AVRWGWEMSA-N
Mol Weight 440.5 g/mol
Molecular Formula C25H32N2O5
Exact Mass 440.231122 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID J9kGcAeklA3
Name Benzyl-[(R)-2-(tert-Butoxycarbonylamino)-2-methyl-3-phenylpropanoyl]-L-alaninate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H32N2O5
InChI InChI=1S/C25H32N2O5/c1-18(21(28)31-17-20-14-10-7-11-15-20)26-22(29)25(5,16-19-12-8-6-9-13-19)27-23(30)32-24(2,3)4/h6-15,18H,16-17H2,1-5H3,(H,26,29)(H,27,30)/t18-,25+/m0/s1
InChIKey IAIXGHVBGAFHTQ-AVRWGWEMSA-N
Molecular Weight 440.540 g/mol
SMILES N(C([C@](NC(OC(C)(C)C)=O)(Cc1ccccc1)C)=O)[C@](C(OCc1ccccc1)=O)(C)[H]
SPLASH splash10-0002-0009000000-cebd8e25e520f428b988
Source of Spectrum KC-57-5780-14
Synonyms benzyl (2S)-2-({(2R)-2-[(tert-butoxycarbonyl)amino]-2-methyl-3-phenylpropanoyl}amino)propanoate [(R)-2-(tert-Butoxycarbonylamino)-2-methyl-3-phenylpropanoyl]-L-alanine
Wiley ID 1624888