CID 3046202

N,n'-(2-hydroxy-1,3-propanediyl)bisdecanamide

Structural Information

Molecular Formula
C23H46N2O3
SMILES
CCCCCCCCCC(=O)NCC(CNC(=O)CCCCCCCCC)O
InChI
InChI=1S/C23H46N2O3/c1-3-5-7-9-11-13-15-17-22(27)24-19-21(26)20-25-23(28)18-16-14-12-10-8-6-4-2/h21,26H,3-20H2,1-2H3,(H,24,27)(H,25,28)
InChIKey
ULQJGFQMGZOCNS-UHFFFAOYSA-N
Compound name
N-[3-(decanoylamino)-2-hydroxypropyl]decanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

398.35083 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 399.35811 210.8
[M+Na]+ 421.34005 208.6
[M-H]- 397.34355 206.5
[M+NH4]+ 416.38465 223.1
[M+K]+ 437.31399 205.0
[M+H-H2O]+ 381.34809 202.3
[M+HCOO]- 443.34903 226.7
[M+CH3COO]- 457.36468 230.7
[M+Na-2H]- 419.32550 205.2
[M]+ 398.35028 215.6
[M]- 398.35138 215.6
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