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

*Links on SpectraBase are not permalinks.
7-methyl-2-(4-chloro3-methylphenoxymethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
SpectraBase Compound ID uef4W1E2xk
InChI InChI=1S/C14H12ClN3O2S/c1-8-5-10(3-4-11(8)15)20-7-12-17-18-13(19)6-9(2)16-14(18)21-12/h3-6H,7H2,1-2H3
InChIKey VIRCFKHDGYKTAH-UHFFFAOYSA-N
Mol Weight 321.78 g/mol
Molecular Formula C14H12ClN3O2S
Exact Mass 321.033876 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 KH4f4GB2olC
Name 7-methyl-2-(4-chloro3-methylphenoxymethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Alternate Name(s) 2-[(4-chloro-3-methylphenoxy)methyl]-7-methyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one 2-[(4-chloranyl-3-methyl-phenoxy)methyl]-7-methyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12ClN3O2S
InChI InChI=1S/C14H12ClN3O2S/c1-8-5-10(3-4-11(8)15)20-7-12-17-18-13(19)6-9(2)16-14(18)21-12/h3-6H,7H2,1-2H3
InChIKey VIRCFKHDGYKTAH-UHFFFAOYSA-N
Molecular Weight 321.782 g/mol
SMILES C=12N(N=C(S2)COc2cc(C)c(cc2)Cl)C(C=C(N1)C)=O
SPLASH splash10-00di-0009000000-2e3348f7b8d4588d58fa
Source of Spectrum G2-19-219-6f
Wiley ID 1705401