CID 46318284

1-(pyrrolidin-3-yl)-1h-pyrazole

Structural Information

Molecular Formula
C7H11N3
SMILES
C1CNCC1N2C=CC=N2
InChI
InChI=1S/C7H11N3/c1-3-9-10(5-1)7-2-4-8-6-7/h1,3,5,7-8H,2,4,6H2
InChIKey
ZUZKWDPTWJFIPQ-UHFFFAOYSA-N
Compound name
1-pyrrolidin-3-ylpyrazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

137.09529 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.10257 128.5
[M+Na]+ 160.08451 135.4
[M-H]- 136.08801 129.6
[M+NH4]+ 155.12911 148.5
[M+K]+ 176.05845 133.5
[M+H-H2O]+ 120.09255 120.1
[M+HCOO]- 182.09349 148.4
[M+CH3COO]- 196.10914 141.1
[M+Na-2H]- 158.06996 132.2
[M]+ 137.09474 123.5
[M]- 137.09584 123.5
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