CID 109492

68123-40-0

Structural Information

Molecular Formula
C23H47N2O
SMILES
CCCCCCCCCCCCCCCCCC(=O)N[N+](C)(C)CC=C
InChI
InChI=1S/C23H46N2O/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(26)24-25(3,4)22-6-2/h6H,2,5,7-22H2,1,3-4H3/p+1
InChIKey
BWHSTWGLHNATDS-UHFFFAOYSA-O
Compound name
dimethyl-(octadecanoylamino)-prop-2-enylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

367.36884 Da
Monoisotopic Mass

8.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.37612 201.7
[M+Na]+ 390.35806 201.4
[M-H]- 366.36156 200.7
[M+NH4]+ 385.40266 227.3
[M+K]+ 406.33200 192.0
[M+H-H2O]+ 350.36610 196.7
[M+HCOO]- 412.36704 242.2
[M+CH3COO]- 426.38269 224.5
[M+Na-2H]- 388.34351 202.8
[M]+ 367.36829 206.8
[M]- 367.36939 206.8
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.