CID 82417223

1-methyl-5-(pyrrolidin-3-yl)-1h-pyrazole hydrochloride

Structural Information

Molecular Formula
C8H13N3
SMILES
CN1C(=CC=N1)C2CCNC2
InChI
InChI=1S/C8H13N3/c1-11-8(3-5-10-11)7-2-4-9-6-7/h3,5,7,9H,2,4,6H2,1H3
InChIKey
PZNBWWUBSBNMEC-UHFFFAOYSA-N
Compound name
1-methyl-5-pyrrolidin-3-ylpyrazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

151.11095 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.118226 133.1
[M+Na]+ 174.100168 140.6
[M-H]- 150.103674 134.5
[M+NH4]+ 169.144773 152.9
[M+K]+ 190.074108 138.3
[M+H-H2O]+ 134.108210 125.0
[M+HCOO]- 196.109151 152.7
[M+CH3COO]- 210.124801 145.7
[M+Na-2H]- 172.085616 135.6
[M]+ 151.11040142 128.9
[M]- 151.11149858 128.9
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.