CID 18735264

4-methyl-5-(methylsulfanyl)-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C5H8N2S2
SMILES
CC1=C(SC(=N1)N)SC
InChI
InChI=1S/C5H8N2S2/c1-3-4(8-2)9-5(6)7-3/h1-2H3,(H2,6,7)
InChIKey
IFCGTPBUMBVLLO-UHFFFAOYSA-N
Compound name
4-methyl-5-methylsulfanyl-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

160.0129 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.02018 127.7
[M+Na]+ 183.00212 138.5
[M-H]- 159.00562 130.5
[M+NH4]+ 178.04672 149.9
[M+K]+ 198.97606 134.8
[M+H-H2O]+ 143.01016 122.4
[M+HCOO]- 205.01110 142.1
[M+CH3COO]- 219.02675 177.2
[M+Na-2H]- 180.98757 127.6
[M]+ 160.01235 129.5
[M]- 160.01345 129.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe