CID 97916

12-hydroxy-n-(2-hydroxyethyl)octadecanamide

Structural Information

Molecular Formula
C20H41NO3
SMILES
CCCCCCC(CCCCCCCCCCC(=O)NCCO)O
InChI
InChI=1S/C20H41NO3/c1-2-3-4-11-14-19(23)15-12-9-7-5-6-8-10-13-16-20(24)21-17-18-22/h19,22-23H,2-18H2,1H3,(H,21,24)
InChIKey
OZSKVMIBRHDIET-UHFFFAOYSA-N
Compound name
12-hydroxy-N-(2-hydroxyethyl)octadecanamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

1045
Patents

343.30865 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.31593 195.3
[M+Na]+ 366.29787 194.7
[M-H]- 342.30137 190.1
[M+NH4]+ 361.34247 206.9
[M+K]+ 382.27181 190.9
[M+H-H2O]+ 326.30591 187.8
[M+HCOO]- 388.30685 211.4
[M+CH3COO]- 402.32250 214.9
[M+Na-2H]- 364.28332 191.6
[M]+ 343.30810 199.4
[M]- 343.30920 199.4
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