CID 1080491

N-((pyridin-2-yl)methyl)cyclopropanamine

Structural Information

Molecular Formula
C9H12N2
SMILES
C1CC1NCC2=CC=CC=N2
InChI
InChI=1S/C9H12N2/c1-2-6-10-9(3-1)7-11-8-4-5-8/h1-3,6,8,11H,4-5,7H2
InChIKey
SVMBYSXPVZASTL-UHFFFAOYSA-N
Compound name
N-(pyridin-2-ylmethyl)cyclopropanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

44
Patents

148.10005 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.10733 131.3
[M+Na]+ 171.08927 139.9
[M-H]- 147.09277 137.3
[M+NH4]+ 166.13387 146.0
[M+K]+ 187.06321 136.8
[M+H-H2O]+ 131.09731 123.7
[M+HCOO]- 193.09825 156.3
[M+CH3COO]- 207.11390 180.8
[M+Na-2H]- 169.07472 140.3
[M]+ 148.09950 132.0
[M]- 148.10060 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