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

*Links on SpectraBase are not permalinks.
5-Pyrimidinecarboxylic acid, 4-(1,3-benzodioxol-5-yl)-6-[(3,5-dimethyl-1-piperidinyl)methyl]-1,2,3,4-tetrahydro-2-oxo-, ethyl ester
SpectraBase Compound ID HdXaKp6wXKC
InChI InChI=1S/C22H29N3O5/c1-4-28-21(26)19-16(11-25-9-13(2)7-14(3)10-25)23-22(27)24-20(19)15-5-6-17-18(8-15)30-12-29-17/h5-6,8,13-14,20H,4,7,9-12H2,1-3H3,(H2,23,24,27)
InChIKey JGJYVIGWLAJVFX-UHFFFAOYSA-N
Mol Weight 415.49 g/mol
Molecular Formula C22H29N3O5
Exact Mass 415.210721 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 E6vAxNgZq5A
Name 5-Pyrimidinecarboxylic acid, 4-(1,3-benzodioxol-5-yl)-6-[(3,5-dimethyl-1-piperidinyl)methyl]-1,2,3,4-tetrahydro-2-oxo-, ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29N3O5
InChI InChI=1S/C22H29N3O5/c1-4-28-21(26)19-16(11-25-9-13(2)7-14(3)10-25)23-22(27)24-20(19)15-5-6-17-18(8-15)30-12-29-17/h5-6,8,13-14,20H,4,7,9-12H2,1-3H3,(H2,23,24,27)
InChIKey JGJYVIGWLAJVFX-UHFFFAOYSA-N
Molecular Weight 415.490 g/mol
SMILES N1C(NC(C(=C1CN1CC(C)CC(C1)C)C(=O)OCC)c1cc2OCOc2cc1)=O
SPLASH splash10-03dl-1961100000-273510a7067ee52b89d7
Source of Spectrum IY-1-4504-1
Synonyms 4-(1,3-benzodioxol-5-yl)-6-[(3,5-dimethyl-1-piperidinyl)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Ethyl 4-(1,3-benzodioxol-5-yl)-6-[(3,5-dimethylpiperidin-1-yl)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Ethyl 4-(1,3-benzodioxol-5-yl)-6-[(3,5-dimethyl-1-piperidyl)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Ethyl 4-(1,3-benzodioxol-5-yl)-6-[(3,5-dimethylpiperidin-1-yl)methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Wiley ID 1653024