CID 112551

63059-80-3

Structural Information

Molecular Formula
C33H60N2O6
SMILES
CCCCCCCCCCCC(=O)OCCN1C(=O)C(N(C1=O)CCOC(=O)CCCCCCCCCCC)(C)C
InChI
InChI=1S/C33H60N2O6/c1-5-7-9-11-13-15-17-19-21-23-29(36)40-27-25-34-31(38)33(3,4)35(32(34)39)26-28-41-30(37)24-22-20-18-16-14-12-10-8-6-2/h5-28H2,1-4H3
InChIKey
GIOMCCKTXLHGSZ-UHFFFAOYSA-N
Compound name
2-[3-(2-dodecanoyloxyethyl)-4,4-dimethyl-2,5-dioxoimidazolidin-1-yl]ethyl dodecanoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

355
Patents

580.4451 Da
Monoisotopic Mass

10.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 581.45238 254.6
[M+Na]+ 603.43432 254.6
[M+NH4]+ 598.47892 254.7
[M+K]+ 619.40826 254.1
[M-H]- 579.43782 242.9
[M+Na-2H]- 601.41977 254.3
[M]+ 580.44455 251.4
[M]- 580.44565 251.4
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