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

*Links on SpectraBase are not permalinks.
(R)-3-Dibenzylamino-pentanoic acid ((1S,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl)-methyl-amide
SpectraBase Compound ID EHdskWIe8gc
InChI InChI=1S/C29H36N2O2/c1-4-27(20-28(32)30(3)23(2)29(33)26-18-12-7-13-19-26)31(21-24-14-8-5-9-15-24)22-25-16-10-6-11-17-25/h5-19,23,27,29,33H,4,20-22H2,1-3H3/t23-,27+,29+/m0/s1
InChIKey XWSAFRLIGAXWHB-TZIIFLTASA-N
Mol Weight 444.6 g/mol
Molecular Formula C29H36N2O2
Exact Mass 444.277678 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 CkoAMyIiqde
Name (R)-3-Dibenzylamino-pentanoic acid ((1S,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl)-methyl-amide
Alternate Name(s) (+)-(1'S,2'S,3R)-3-Dibenzylamino-N-methyl-N-(2'-phenyl-2'-hydroxy-1'-methylethyl)pentanamide (3R)-3-(dibenzylamino)-N-[(1S,2S)-2-hydroxy-1-methyl-2-phenylethyl]-N-methylpentanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H36N2O2
InChI InChI=1S/C29H36N2O2/c1-4-27(20-28(32)30(3)23(2)29(33)26-18-12-7-13-19-26)31(21-24-14-8-5-9-15-24)22-25-16-10-6-11-17-25/h5-19,23,27,29,33H,4,20-22H2,1-3H3/t23-,27+,29+/m0/s1
InChIKey XWSAFRLIGAXWHB-TZIIFLTASA-N
Molecular Weight 444.619 g/mol
SMILES O[C@]([C@@](N(C(C[C@](N(Cc1ccccc1)Cc1ccccc1)(CC)[H])=O)C)(C)[H])(c1ccccc1)[H]
SPLASH splash10-0006-9211000000-1ba3c910a3ae626a7220
Source of Spectrum F-70-8798-2
Wiley ID 1597684