CID 90575

4h-1,3-thiazin-4-one, 2-amino-5,6-dihydro-, monohydrochloride

Structural Information

Molecular Formula
C4H6N2OS
SMILES
C1CSC(=NC1=O)N
InChI
InChI=1S/C4H6N2OS/c5-4-6-3(7)1-2-8-4/h1-2H2,(H2,5,6,7)
InChIKey
YSHYSAKBZQCSQY-UHFFFAOYSA-N
Compound name
2-amino-5,6-dihydro-1,3-thiazin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

130.02008 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.02736 122.6
[M+Na]+ 153.00930 133.2
[M+NH4]+ 148.05390 131.5
[M+K]+ 168.98324 126.2
[M-H]- 129.01280 124.5
[M+Na-2H]- 150.99475 127.9
[M]+ 130.01953 124.8
[M]- 130.02063 124.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe