CID 82596924

1,4-dimethyl-3-(pyrrolidin-2-yl)-1h-pyrazole dihydrochloride

Structural Information

Molecular Formula
C9H15N3
SMILES
CC1=CN(N=C1C2CCCN2)C
InChI
InChI=1S/C9H15N3/c1-7-6-12(2)11-9(7)8-4-3-5-10-8/h6,8,10H,3-5H2,1-2H3
InChIKey
IRWCBJCIYLCNFW-UHFFFAOYSA-N
Compound name
1,4-dimethyl-3-pyrrolidin-2-ylpyrazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.1266 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.133876 137.7
[M+Na]+ 188.115818 145.7
[M-H]- 164.119324 139.3
[M+NH4]+ 183.160423 157.3
[M+K]+ 204.089758 143.1
[M+H-H2O]+ 148.123860 129.7
[M+HCOO]- 210.124801 157.0
[M+CH3COO]- 224.140451 150.2
[M+Na-2H]- 186.101266 139.0
[M]+ 165.12605142 134.2
[M]- 165.12714858 134.2
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.