CID 12030188

Hydroxypropyl bislauramide monoethanolamide

Structural Information

Molecular Formula
C31H62N2O5
SMILES
CCCCCCCCCCCC(=O)N(CCO)CC(CN(CCO)C(=O)CCCCCCCCCCC)O
InChI
InChI=1S/C31H62N2O5/c1-3-5-7-9-11-13-15-17-19-21-30(37)32(23-25-34)27-29(36)28-33(24-26-35)31(38)22-20-18-16-14-12-10-8-6-4-2/h29,34-36H,3-28H2,1-2H3
InChIKey
JRKSTJIPGYBLNV-UHFFFAOYSA-N
Compound name
N-[3-[dodecanoyl(2-hydroxyethyl)amino]-2-hydroxypropyl]-N-(2-hydroxyethyl)dodecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

170
Patents

542.4659 Da
Monoisotopic Mass

7.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 543.47318 253.2
[M+Na]+ 565.45512 261.4
[M-H]- 541.45862 248.2
[M+NH4]+ 560.49972 256.4
[M+K]+ 581.42906 260.0
[M+H-H2O]+ 525.46316 252.8
[M+HCOO]- 587.46410 247.8
[M+CH3COO]- 601.47975 258.9
[M+Na-2H]- 563.44057 238.7
[M]+ 542.46535 248.0
[M]- 542.46645 248.0
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