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

*Links on SpectraBase are not permalinks.

(2R,5R,6S)-1-Benzoyl-2-tert-butyl-3,6-dimethyl-5-[1'(S)-hydroxyisobutyl]tetrahydropyrimidin-4-one

View entire compound with spectra: 1 MS (GC)

(2R,5R,6S)-1-Benzoyl-2-tert-butyl-3,6-dimethyl-5-[1'(S)-hydroxyisobutyl]tetrahydropyrimidin-4-one
SpectraBase Compound ID EHl8NchWqtg
InChI InChI=1S/C21H32N2O3/c1-13(2)17(24)16-14(3)23(18(25)15-11-9-8-10-12-15)20(21(4,5)6)22(7)19(16)26/h8-14,16-17,20,24H,1-7H3/t14-,16+,17-,20+/m0/s1
InChIKey FMOLYTGLFWFIJP-DZIWXPPMSA-N
Mol Weight 360.5 g/mol
Molecular Formula C21H32N2O3
Exact Mass 360.241293 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 KaPoU6mowln
Name (2R,5R,6S)-1-Benzoyl-2-tert-butyl-3,6-dimethyl-5-[1'(S)-hydroxyisobutyl]tetrahydropyrimidin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32N2O3
InChI InChI=1S/C21H32N2O3/c1-13(2)17(24)16-14(3)23(18(25)15-11-9-8-10-12-15)20(21(4,5)6)22(7)19(16)26/h8-14,16-17,20,24H,1-7H3/t14-,16+,17-,20+/m0/s1
InChIKey FMOLYTGLFWFIJP-DZIWXPPMSA-N
Molecular Weight 360.498 g/mol
SMILES O[C@]([C@@]1(C(=O)N([C@](N([C@]1(C)[H])C(=O)c1ccccc1)(C(C)(C)C)[H])C)[H])(C(C)C)[H]
SPLASH splash10-0pb9-4906000000-910be599a19adb0efce4
Source of Spectrum H1-39-338-18
Synonyms (2R,5R,6S)-1-benzoyl-2-tert-butyl-5-[(1S)-1-hydroxy-2-methylpropyl]-3,6-dimethyltetrahydro-4(1H)-pyrimidinone 1-Benzoyl-2(S)-tert-butyl-3,6(R)-dimethyl-5(S)-[1'(S)-hydroxyisobutyl]tetrahydropyrimidin-4-one
Wiley ID 756790