CID 136307804

3-cyclopropyl-4h,5h,6h,7h-pyrazolo[1,5-a]pyrimidine

Structural Information

Molecular Formula
C9H13N3
SMILES
C1CNC2=C(C=NN2C1)C3CC3
InChI
InChI=1S/C9H13N3/c1-4-10-9-8(7-2-3-7)6-11-12(9)5-1/h6-7,10H,1-5H2
InChIKey
YBCVRCYWOUQGLX-UHFFFAOYSA-N
Compound name
3-cyclopropyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.11095 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.11823 143.3
[M+Na]+ 186.10017 152.7
[M-H]- 162.10367 145.7
[M+NH4]+ 181.14477 157.0
[M+K]+ 202.07411 147.7
[M+H-H2O]+ 146.10821 134.8
[M+HCOO]- 208.10915 160.6
[M+CH3COO]- 222.12480 154.5
[M+Na-2H]- 184.08562 148.0
[M]+ 163.11040 140.8
[M]- 163.11150 140.8
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.