CID 137951866

5-[(azetidin-3-yl)methyl]-1h-pyrazole hydrochloride

Structural Information

Molecular Formula
C7H11N3
SMILES
C1C(CN1)CC2=CC=NN2
InChI
InChI=1S/C7H11N3/c1-2-9-10-7(1)3-6-4-8-5-6/h1-2,6,8H,3-5H2,(H,9,10)
InChIKey
BGRCFWSVPJPSLC-UHFFFAOYSA-N
Compound name
5-(azetidin-3-ylmethyl)-1H-pyrazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
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 126.8
[M+Na]+ 160.08451 132.6
[M-H]- 136.08801 126.5
[M+NH4]+ 155.12911 138.3
[M+K]+ 176.05845 132.4
[M+H-H2O]+ 120.09255 114.1
[M+HCOO]- 182.09349 144.2
[M+CH3COO]- 196.10914 170.5
[M+Na-2H]- 158.06996 132.2
[M]+ 137.09474 130.4
[M]- 137.09584 130.4
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.