CID 6438044

Linoleylamine

Structural Information

Molecular Formula

C₁₈H₃₅N

SMILES

CCCCC/C=C\C/C=C\CCCCCCCCN

InChI

InChI=1S/C18H35N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h6-7,9-10H,2-5,8,11-19H2,1H3/b7-6-,10-9-

InChIKey

GOLAKLHPPDDLST-HZJYTTRNSA-N

Compound name

(9Z,12Z)-octadeca-9,12-dien-1-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 1473
Patents: 265.27695 Da
Monoisotopic Mass: 6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	266.28423	174.6
[M+Na]+	288.26617	176.7
[M-H]-	264.26967	172.2
[M+NH4]+	283.31077	191.0
[M+K]+	304.24011	171.8
[M+H-H2O]+	248.27421	167.8
[M+HCOO]-	310.27515	195.3
[M+CH3COO]-	324.29080	204.6
[M+Na-2H]-	286.25162	174.5
[M]+	265.27640	177.1
[M]-	265.27750	177.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe