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

*Links on SpectraBase are not permalinks.
Thiocyanic acid, 6-amino-2-(ethylthio)-1,4-dihydro-4-oxo-5-pyrimidinyl ester
SpectraBase Compound ID 3wk3JbZy0q9
InChI InChI=1S/C7H8N4OS2/c1-2-13-7-10-5(9)4(14-3-8)6(12)11-7/h2H2,1H3,(H3,9,10,11,12)
InChIKey LHCCOSRKZPPMRH-UHFFFAOYSA-N
Mol Weight 228.29 g/mol
Molecular Formula C7H8N4OS2
Exact Mass 228.013953 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 DpxZZnyioaE
Name Thiocyanic acid, 6-amino-2-(ethylthio)-1,4-dihydro-4-oxo-5-pyrimidinyl ester
Alternate Name(s) 4-Amino-2-ethylthio-6-hydroxypyrimidine 6-Amino-2-(ethylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinyl thiocyanate
CAS Registry Number 77708-92-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8N4OS2
InChI InChI=1S/C7H8N4OS2/c1-2-13-7-10-5(9)4(14-3-8)6(12)11-7/h2H2,1H3,(H3,9,10,11,12)
InChIKey LHCCOSRKZPPMRH-UHFFFAOYSA-N
Molecular Weight 228.288 g/mol
SMILES N1C(N)=C(C(N=C1SCC)=O)SC#N
SPLASH splash10-0ufr-0690000000-9ed3be3a976cb7dd2973
Source of Spectrum Y-17-1590-0
Wiley ID 1229018