CID 44251307

7-chloro-2-methylpyrazolo[1,5-a]pyrimidin-5-amine

Structural Information

Molecular Formula
C7H7ClN4
SMILES
CC1=NN2C(=C1)N=C(C=C2Cl)N
InChI
InChI=1S/C7H7ClN4/c1-4-2-7-10-6(9)3-5(8)12(7)11-4/h2-3H,1H3,(H2,9,10)
InChIKey
VOWVPHOKWZLZLV-UHFFFAOYSA-N
Compound name
7-chloro-2-methylpyrazolo[1,5-a]pyrimidin-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

182.03592 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.043196 134.6
[M+Na]+ 205.025138 148.1
[M-H]- 181.028644 135.9
[M+NH4]+ 200.069743 154.6
[M+K]+ 220.999078 143.2
[M+H-H2O]+ 165.033180 127.7
[M+HCOO]- 227.034121 153.6
[M+CH3COO]- 241.049771 148.8
[M+Na-2H]- 203.010586 142.0
[M]+ 182.03537142 137.6
[M]- 182.03646858 137.6
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

patents stripe