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]+ 207.13527 146.3
[M+Na]+ 229.11721 157.1
[M-H]- 205.12071 146.6
[M+NH4]+ 224.16181 162.7
[M+K]+ 245.09115 153.7
[M+H-H2O]+ 189.12525 137.8
[M+HCOO]- 251.12619 168.2
[M+CH3COO]- 265.14184 193.2
[M+Na-2H]- 227.10266 152.7
[M]+ 206.12744 147.6
[M]- 206.12854 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.