CID 45092657

82020-89-1

Structural Information

Molecular Formula
C7H12N4
SMILES
CC1=NC(=NC(=N1)N)C(C)C
InChI
InChI=1S/C7H12N4/c1-4(2)6-9-5(3)10-7(8)11-6/h4H,1-3H3,(H2,8,9,10,11)
InChIKey
FSXYDLJFFPKKKD-UHFFFAOYSA-N
Compound name
4-methyl-6-propan-2-yl-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

152.1062 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.113476 133.9
[M+Na]+ 175.095418 143.2
[M-H]- 151.098924 133.7
[M+NH4]+ 170.140023 151.1
[M+K]+ 191.069358 141.2
[M+H-H2O]+ 135.103460 126.3
[M+HCOO]- 197.104401 154.6
[M+CH3COO]- 211.120051 180.8
[M+Na-2H]- 173.080866 139.9
[M]+ 152.10565142 133.1
[M]- 152.10674858 133.1
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