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

*Links on SpectraBase are not permalinks.
2-[Formyl(5'-chlorosalicyl)methylidene]-hexahydropyrimidine
SpectraBase Compound ID EV7WrIFC3pW
InChI InChI=1S/C13H13ClN2O3/c14-8-2-3-11(18)9(6-8)12(19)10(7-17)13-15-4-1-5-16-13/h2-3,6-7,15-16,18H,1,4-5H2
InChIKey XRDXKTNEWYASOT-UHFFFAOYSA-N
Mol Weight 280.71 g/mol
Molecular Formula C13H13ClN2O3
Exact Mass 280.06147 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 KBnwMXcLFCf
Name 2-[Formyl(5'-chlorosalicyl)methylidene]-hexahydropyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClN2O3
InChI InChI=1S/C13H13ClN2O3/c14-8-2-3-11(18)9(6-8)12(19)10(7-17)13-15-4-1-5-16-13/h2-3,6-7,15-16,18H,1,4-5H2
InChIKey XRDXKTNEWYASOT-UHFFFAOYSA-N
Molecular Weight 280.711 g/mol
SMILES Oc1c(C(C(=C2NCCCN2)C=O)=O)cc(cc1)Cl
SPLASH splash10-0002-6590000000-f8bff124ec3a0879478d
Source of Spectrum D1-2003-258-7
Synonyms 3-(5-Chloro-2-hydroxyphenyl)-3-oxo-2-tetrahydro-2(1H)-pyrimidinylidenepropanal 3-(5-Chloro-2-hydroxyphenyl)-2-(1,3-diazinan-2-ylidene)-3-oxopropanal 3-(5-Chloro-2-hydroxy-phenyl)-2-hexahydropyrimidin-2-ylidene-3-oxo-propanal 3-(5-Chloranyl-2-oxidanyl-phenyl)-2-(1,3-diazinan-2-ylidene)-3-oxidanylidene-propanal
Wiley ID 1548229