CID 75525486

(hex-5-en-2-yl)[2-(pyridin-2-yl)ethyl]amine

Structural Information

Molecular Formula
C13H20N2
SMILES
CC(CCC=C)NCCC1=CC=CC=N1
InChI
InChI=1S/C13H20N2/c1-3-4-7-12(2)14-11-9-13-8-5-6-10-15-13/h3,5-6,8,10,12,14H,1,4,7,9,11H2,2H3
InChIKey
JOYJMKIXSZAKQW-UHFFFAOYSA-N
Compound name
N-(2-pyridin-2-ylethyl)hex-5-en-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.16264 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.169916 149.9
[M+Na]+ 227.151858 154.8
[M-H]- 203.155364 151.2
[M+NH4]+ 222.196463 167.2
[M+K]+ 243.125798 151.6
[M+H-H2O]+ 187.159900 142.3
[M+HCOO]- 249.160841 172.1
[M+CH3COO]- 263.176491 190.9
[M+Na-2H]- 225.137306 155.2
[M]+ 204.16209142 149.7
[M]- 204.16318858 149.7
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

No patent data available for this compound.