CID 5357010

Oleyldimethylamine

Structural Information

Molecular Formula
C20H41N
SMILES
CCCCCCCC/C=C\CCCCCCCCN(C)C
InChI
InChI=1S/C20H41N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2)3/h11-12H,4-10,13-20H2,1-3H3/b12-11-
InChIKey
DCNHQNGFLVPROM-QXMHVHEDSA-N
Compound name
(Z)-N,N-dimethyloctadec-9-en-1-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2870
Patents

295.3239 Da
Monoisotopic Mass

8.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.33118 185.6
[M+Na]+ 318.31312 186.7
[M-H]- 294.31662 184.7
[M+NH4]+ 313.35772 201.6
[M+K]+ 334.28706 183.5
[M+H-H2O]+ 278.32116 178.1
[M+HCOO]- 340.32210 206.4
[M+CH3COO]- 354.33775 216.3
[M+Na-2H]- 316.29857 184.6
[M]+ 295.32335 191.9
[M]- 295.32445 191.9
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