CID 11214516

Dioleylamine

Structural Information

Molecular Formula
C36H71N
SMILES
CCCCCCCC/C=C\CCCCCCCCNCCCCCCCC/C=C\CCCCCCCC
InChI
InChI=1S/C36H71N/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,37H,3-16,21-36H2,1-2H3/b19-17-,20-18-
InChIKey
JTQQDDNCCLCMER-CLFAGFIQSA-N
Compound name
(Z)-N-[(Z)-octadec-9-enyl]octadec-9-en-1-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3060
Patents

517.55865 Da
Monoisotopic Mass

15.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 518.56593 260.7
[M+Na]+ 540.54787 268.0
[M-H]- 516.55137 241.0
[M+NH4]+ 535.59247 255.1
[M+K]+ 556.52181 267.3
[M+H-H2O]+ 500.55591 239.8
[M+HCOO]- 562.55685 268.4
[M+CH3COO]- 576.57250 258.3
[M+Na-2H]- 538.53332 241.8
[M]+ 517.55810 258.7
[M]- 517.55920 258.7
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

patents stripe