CID 44151010

Einecs 278-583-8

Structural Information

Molecular Formula
C24H48N2O4
SMILES
CCCCC(CC)CC(CCCCCOC(=O)N)(CC(CC)CCCC)OC(=O)N
InChI
InChI=1S/C24H48N2O4/c1-5-9-14-20(7-3)18-24(30-23(26)28,19-21(8-4)15-10-6-2)16-12-11-13-17-29-22(25)27/h20-21H,5-19H2,1-4H3,(H2,25,27)(H2,26,28)
InChIKey
FZSCGPCBOHYOBC-UHFFFAOYSA-N
Compound name
[6-carbamoyloxy-8-ethyl-6-(2-ethylhexyl)dodecyl] carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

428.36142 Da
Monoisotopic Mass

7.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 429.36870 213.3
[M+Na]+ 451.35064 223.3
[M-H]- 427.35414 211.1
[M+NH4]+ 446.39524 216.2
[M+K]+ 467.32458 219.4
[M+H-H2O]+ 411.35868 209.8
[M+HCOO]- 473.35962 214.6
[M+CH3COO]- 487.37527 238.1
[M+Na-2H]- 449.33609 210.2
[M]+ 428.36087 209.4
[M]- 428.36197 209.4
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

No patent data available for this compound.