CID 4723809

N-(2-pyridinylmethyl)-2-propen-1-amine

Structural Information

Molecular Formula
C9H12N2
SMILES
C=CCNCC1=CC=CC=N1
InChI
InChI=1S/C9H12N2/c1-2-6-10-8-9-5-3-4-7-11-9/h2-5,7,10H,1,6,8H2
InChIKey
QWYUXVMDZOWGNV-UHFFFAOYSA-N
Compound name
N-(pyridin-2-ylmethyl)prop-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
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 130.9
[M+Na]+ 171.089268 137.8
[M-H]- 147.092774 132.9
[M+NH4]+ 166.133873 150.5
[M+K]+ 187.063208 135.2
[M+H-H2O]+ 131.097310 124.1
[M+HCOO]- 193.098251 155.5
[M+CH3COO]- 207.113901 177.9
[M+Na-2H]- 169.074716 139.7
[M]+ 148.09950142 129.9
[M]- 148.10059858 129.9
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