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]+ 183.04320 134.6
[M+Na]+ 205.02514 148.1
[M-H]- 181.02864 135.9
[M+NH4]+ 200.06974 154.6
[M+K]+ 220.99908 143.2
[M+H-H2O]+ 165.03318 127.7
[M+HCOO]- 227.03412 153.6
[M+CH3COO]- 241.04977 148.8
[M+Na-2H]- 203.01059 142.0
[M]+ 182.03537 137.6
[M]- 182.03647 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