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

*Links on SpectraBase are not permalinks.
Carbamic acid, [4-[3-benzoyl-2-(1,1-dimethylethyl)-1,4-dimethyl-5-oxo-4-imidazolidinyl]butyl]-, phenylmethyl ester, (2S-cis)-
SpectraBase Compound ID 7tS0hSaJLqx
InChI InChI=1S/C28H37N3O4/c1-27(2,3)24-30(5)25(33)28(4,31(24)23(32)22-16-10-7-11-17-22)18-12-13-19-29-26(34)35-20-21-14-8-6-9-15-21/h6-11,14-17,24H,12-13,18-20H2,1-5H3,(H,29,34)/t24-,28+/m0/s1
InChIKey XCHIRJOBCXYGAB-RBJSKKJNSA-N
Mol Weight 479.6 g/mol
Molecular Formula C28H37N3O4
Exact Mass 479.278407 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 3xKGplcy81c
Name Carbamic acid, [4-[3-benzoyl-2-(1,1-dimethylethyl)-1,4-dimethyl-5-oxo-4-imidazolidinyl]butyl]-, phenylmethyl ester, (2S-cis)-
Alternate Name(s) (2S,5R)-1-benzoyl-5-{4'-[benzyloxycarbonyl)amino]butyl}-2-t-butyl-3,5-dimethyl-4-imidazolidone benzyl 4-[(2S,4R)-3-benzoyl-2-tert-butyl-1,4-dimethyl-5-oxoimidazolidinyl]butylcarbamate
CAS Registry Number 116139-71-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H37N3O4
InChI InChI=1S/C28H37N3O4/c1-27(2,3)24-30(5)25(33)28(4,31(24)23(32)22-16-10-7-11-17-22)18-12-13-19-29-26(34)35-20-21-14-8-6-9-15-21/h6-11,14-17,24H,12-13,18-20H2,1-5H3,(H,29,34)/t24-,28+/m0/s1
InChIKey XCHIRJOBCXYGAB-RBJSKKJNSA-N
Molecular Weight 479.621 g/mol
SMILES N(C(=O)OCc1ccccc1)CCCC[C@]1(N([C@](N(C)C1=O)(C(C)(C)C)[H])C(=O)c1ccccc1)C
SPLASH splash10-0a4i-6912100000-af223b4bdb432c2b9289
Source of Spectrum H-71-231-11
Wiley ID 1395044