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4-Pyrimidineacetic acid, 1-(1,1-dimethylethyl)hexahydro-3-methyl-2-oxo-, methyl ester, (.+-.)-
SpectraBase Compound ID 4kuieQewDV7
InChI InChI=1S/C12H22N2O3/c1-12(2,3)14-7-6-9(8-10(15)17-5)13(4)11(14)16/h9H,6-8H2,1-5H3
InChIKey ZDLPSMMLCGOMCY-UHFFFAOYSA-N
Mol Weight 242.32 g/mol
Molecular Formula C12H22N2O3
Exact Mass 242.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8W1CQgZEsoc
Name 4-Pyrimidineacetic acid, 1-(1,1-dimethylethyl)hexahydro-3-methyl-2-oxo-, methyl ester, (.+-.)-
CAS Registry Number 114445-11-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22N2O3
InChI InChI=1S/C12H22N2O3/c1-12(2,3)14-7-6-9(8-10(15)17-5)13(4)11(14)16/h9H,6-8H2,1-5H3
InChIKey ZDLPSMMLCGOMCY-UHFFFAOYSA-N
Molecular Weight 242.319 g/mol
SMILES C1(N(CCC(N1C)CC(=O)OC)C(C)(C)C)=O
SPLASH splash10-004i-0190000000-f4eb2ffb61795c45e5d6
Source of Spectrum C-110-4000-0
Synonyms 1-tert-Butyl-3-methyl-4-[(methoxycarbonyl)methyl]-3,4,5,6-tetrahydro-2(1H)-pyrimidinone Methyl (1-tert-butyl-3-methyl-2-oxohexahydro-4-pyrimidinyl)acetate
Wiley ID 1244862