Debug Info

object
{15}
_id
:
32uwOnMRNem
spectrumID
:
32uwOnMRNem
cost
:
1
specType
:
131072
xnmrNucleus
:
0
dbLocation
:
WMS3X:478931:1
hasStructureAssignments
:
false
properties
{12}
analyticalTechnique
:
MS (GC)
analyticalTechniqueLongName
:
Mass Spectrum (GC)
isFullSpectrum
:
false
spectralOutlier
:
false
compound
{10}
lastUpdated
:
1735074081058
isDeprecated
:
false

Logged In :

Authorized Features

  • None
  • DataFullSpectraPoints
  • DataReadAll
  • DataReportGeneration
  • ExportCompound
  • ExportStructure
  • ExportSpectrum
  • ImageFullMS
  • ImageHighRes
  • ImageFullAxis
  • SearchSpectral
  • SearchStructure
ADVERTISEMENT
3-Phenylpropyl 1,6-dimethyl-2-oxo-4-(3-thienyl)-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID 3s8U5hGFhIV
InChI InChI=1S/C20H22N2O3S/c1-14-17(18(16-10-12-26-13-16)21-20(24)22(14)2)19(23)25-11-6-9-15-7-4-3-5-8-15/h3-5,7-8,10,12-13,18H,6,9,11H2,1-2H3,(H,21,24)
InChIKey FDPDAVGMOLOBPK-UHFFFAOYSA-N
Mol Weight 370.47 g/mol
Molecular Formula C20H22N2O3S
Exact Mass 370.135114 g/mol
ADVERTISEMENT

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 32uwOnMRNem
Name 3-Phenylpropyl 1,6-dimethyl-2-oxo-4-(3-thienyl)-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
CAS Registry Number 346725-11-9
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O3S
InChI InChI=1S/C20H22N2O3S/c1-14-17(18(16-10-12-26-13-16)21-20(24)22(14)2)19(23)25-11-6-9-15-7-4-3-5-8-15/h3-5,7-8,10,12-13,18H,6,9,11H2,1-2H3,(H,21,24)
InChIKey FDPDAVGMOLOBPK-UHFFFAOYSA-N
Molecular Weight 370.467 g/mol
SMILES N1C(C(=C(N(C1=O)C)C)C(=O)OCCCc1ccccc1)c1cscc1
SPLASH splash10-0pbc-9573000000-b0b9e0d7106230899115
Source of Spectrum AD-0-2532-0
Synonyms 2-keto-3,4-dimethyl-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylic acid 3-phenylpropyl ester 3,4-Dimethyl-2-oxo-6-(3-thiophenyl)-1,6-dihydropyrimidine-5-carboxylic acid 3-phenylpropyl ester 3-Phenylpropyl 3,4-dimethyl-2-oxidanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate 3-Phenylpropyl 3,4-dimethyl-2-oxo-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylate 3-Phenylpropyl 3,4-dimethyl-2-oxo-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Pyrimidine-5-carboxylic acid, 1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-4-(3-thienyl)-, 3-phenylpropyl ester
Wiley ID 1422168
ADVERTISEMENT