CID 6436062

Diethylene glycol monooleate

Structural Information

Molecular Formula
C22H42O4
SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)OCCOCCO
InChI
InChI=1S/C22H42O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(24)26-21-20-25-19-18-23/h9-10,23H,2-8,11-21H2,1H3/b10-9-
InChIKey
PHDVPEOLXYBNJY-KTKRTIGZSA-N
Compound name
2-(2-hydroxyethoxy)ethyl (Z)-octadec-9-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3824
Patents

370.30832 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.31560 199.3
[M+Na]+ 393.29754 204.9
[M+NH4]+ 388.34214 206.8
[M+K]+ 409.27148 197.2
[M-H]- 369.30104 195.9
[M+Na-2H]- 391.28299 197.2
[M]+ 370.30777 198.6
[M]- 370.30887 198.6
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