CID 23005644

1439905-47-1

Structural Information

Molecular Formula
C7H11N3
SMILES
C1CC2=C(C1)NN=C2CN
InChI
InChI=1S/C7H11N3/c8-4-7-5-2-1-3-6(5)9-10-7/h1-4,8H2,(H,9,10)
InChIKey
JHFGJFWHCHWKFW-UHFFFAOYSA-N
Compound name
1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

137.09529 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.10257 127.7
[M+Na]+ 160.08451 135.8
[M-H]- 136.08801 128.0
[M+NH4]+ 155.12911 150.2
[M+K]+ 176.05845 133.1
[M+H-H2O]+ 120.09255 121.2
[M+HCOO]- 182.09349 149.2
[M+CH3COO]- 196.10914 140.8
[M+Na-2H]- 158.06996 132.2
[M]+ 137.09474 123.7
[M]- 137.09584 123.7
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