CID 1132862

N-[(pyridin-3-yl)methyl]cyclopropanamine

Structural Information

Molecular Formula
C9H12N2
SMILES
C1CC1NCC2=CN=CC=C2
InChI
InChI=1S/C9H12N2/c1-2-8(6-10-5-1)7-11-9-3-4-9/h1-2,5-6,9,11H,3-4,7H2
InChIKey
BZFHAPIXJIHOOF-UHFFFAOYSA-N
Compound name
N-(pyridin-3-ylmethyl)cyclopropanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

41
Patents

148.10005 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.107326 131.3
[M+Na]+ 171.089268 139.9
[M-H]- 147.092774 137.3
[M+NH4]+ 166.133873 146.0
[M+K]+ 187.063208 136.8
[M+H-H2O]+ 131.097310 123.7
[M+HCOO]- 193.098251 156.3
[M+CH3COO]- 207.113901 180.8
[M+Na-2H]- 169.074716 140.3
[M]+ 148.09950142 132.0
[M]- 148.10059858 132.0
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