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

*Links on SpectraBase are not permalinks.
4-Pyrimidineacetic acid, hexahydro-1,3-bis(1-methylethyl)-2-oxo-, methyl ester, (.+-.)-
SpectraBase Compound ID LADkjHKoFi7
InChI InChI=1S/C13H24N2O3/c1-9(2)14-7-6-11(8-12(16)18-5)15(10(3)4)13(14)17/h9-11H,6-8H2,1-5H3
InChIKey NPEVKHPHZPBEHW-UHFFFAOYSA-N
Mol Weight 256.35 g/mol
Molecular Formula C13H24N2O3
Exact Mass 256.178693 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 3w6USo2GoGD
Name 4-Pyrimidineacetic acid, hexahydro-1,3-bis(1-methylethyl)-2-oxo-, methyl ester, (.+-.)-
Alternate Name(s) 1,3-Diisopropyl-4-[(methoxycarbonyl)methyl]-3,4,5,6-tetrahydro-2-(1H)-pyrrimidinone Methyl (1,3-diisopropyl-2-oxohexahydro-4-pyrimidinyl)acetate
CAS Registry Number 114445-13-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24N2O3
InChI InChI=1S/C13H24N2O3/c1-9(2)14-7-6-11(8-12(16)18-5)15(10(3)4)13(14)17/h9-11H,6-8H2,1-5H3
InChIKey NPEVKHPHZPBEHW-UHFFFAOYSA-N
Molecular Weight 256.346 g/mol
SMILES C1(N(C(CC(=O)OC)CCN1C(C)C)C(C)C)=O
SPLASH splash10-0006-0790000000-af6dbc497d049c8c5e8f
Source of Spectrum C-110-4000-0
Wiley ID 1259602