CID 3044742

1,3,5-triazine-2-amine, n,4-dimethyl-6-(methylthio)-

Structural Information

Molecular Formula
C6H10N4S
SMILES
CC1=NC(=NC(=N1)SC)NC
InChI
InChI=1S/C6H10N4S/c1-4-8-5(7-2)10-6(9-4)11-3/h1-3H3,(H,7,8,9,10)
InChIKey
HNCYGGIKTMLOOD-UHFFFAOYSA-N
Compound name
N,4-dimethyl-6-methylsulfanyl-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

170.06262 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.06990 133.6
[M+Na]+ 193.05184 143.9
[M-H]- 169.05534 134.1
[M+NH4]+ 188.09644 151.0
[M+K]+ 209.02578 140.9
[M+H-H2O]+ 153.05988 126.2
[M+HCOO]- 215.06082 151.0
[M+CH3COO]- 229.07647 181.4
[M+Na-2H]- 191.03729 138.8
[M]+ 170.06207 136.0
[M]- 170.06317 136.0
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