CID 6485300

(3-cyclopropyl-1h-pyrazol-5-yl)methanamine

Structural Information

Molecular Formula
C7H11N3
SMILES
C1CC1C2=NNC(=C2)CN
InChI
InChI=1S/C7H11N3/c8-4-6-3-7(10-9-6)5-1-2-5/h3,5H,1-2,4,8H2,(H,9,10)
InChIKey
HBZWOJBTQUEVIF-UHFFFAOYSA-N
Compound name
(3-cyclopropyl-1H-pyrazol-5-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

59
Patents

137.09529 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.10257 129.3
[M+Na]+ 160.08451 139.3
[M-H]- 136.08801 132.8
[M+NH4]+ 155.12911 144.3
[M+K]+ 176.05845 134.8
[M+H-H2O]+ 120.09255 122.1
[M+HCOO]- 182.09349 152.1
[M+CH3COO]- 196.10914 142.2
[M+Na-2H]- 158.06996 134.7
[M]+ 137.09474 128.3
[M]- 137.09584 128.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe