CID 3054726

2-amino-4-isopropylamino-7-methylpyrazolo(1,5-a)-s-triazine methanesulfonate

Structural Information

Molecular Formula
C9H14N6
SMILES
CC1=NN2C(=C1)N=C(N=C2NC(C)C)N
InChI
InChI=1S/C9H14N6/c1-5(2)11-9-13-8(10)12-7-4-6(3)14-15(7)9/h4-5H,1-3H3,(H3,10,11,12,13)
InChIKey
SATNNKOXXCOQHO-UHFFFAOYSA-N
Compound name
7-methyl-4-N-propan-2-ylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.12799 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.135266 146.3
[M+Na]+ 229.117208 157.1
[M-H]- 205.120714 146.6
[M+NH4]+ 224.161813 162.7
[M+K]+ 245.091148 153.7
[M+H-H2O]+ 189.125250 137.8
[M+HCOO]- 251.126191 168.2
[M+CH3COO]- 265.141841 193.2
[M+Na-2H]- 227.102656 152.7
[M]+ 206.12744142 147.6
[M]- 206.12853858 147.6
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

No patent data available for this compound.