CID 22833323

26635-93-8

Structural Information

Molecular Formula
C22H45NO4
SMILES
CCCCCCCC/C=C\CCCCCCCCN(OCCO)OCCO
InChI
InChI=1S/C22H45NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(26-21-19-24)27-22-20-25/h9-10,24-25H,2-8,11-22H2,1H3/b10-9-
InChIKey
JNHVXLWUCMXUNL-KTKRTIGZSA-N
Compound name
2-[2-hydroxyethoxy-[(Z)-octadec-9-enyl]amino]oxyethanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

387.33487 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.34215 204.9
[M+Na]+ 410.32409 203.9
[M-H]- 386.32759 200.5
[M+NH4]+ 405.36869 214.7
[M+K]+ 426.29803 200.5
[M+H-H2O]+ 370.33213 196.4
[M+HCOO]- 432.33307 226.4
[M+CH3COO]- 446.34872 224.4
[M+Na-2H]- 408.30954 202.2
[M]+ 387.33432 213.8
[M]- 387.33542 213.8
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.