CID 6437744

9-octadecenamide, n-(2-hydroxy-1,1-dimethylethyl)-, (9z)-

Structural Information

Molecular Formula
C22H43NO2
SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)NC(C)(C)CO
InChI
InChI=1S/C22H43NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(25)23-22(2,3)20-24/h11-12,24H,4-10,13-20H2,1-3H3,(H,23,25)/b12-11-
InChIKey
KQPDAXCLEYCMKD-QXMHVHEDSA-N
Compound name
(Z)-N-(1-hydroxy-2-methylpropan-2-yl)octadec-9-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.32938 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.33666 199.4
[M+Na]+ 376.31860 199.5
[M-H]- 352.32210 195.6
[M+NH4]+ 371.36320 211.7
[M+K]+ 392.29254 194.9
[M+H-H2O]+ 336.32664 192.4
[M+HCOO]- 398.32758 215.8
[M+CH3COO]- 412.34323 219.5
[M+Na-2H]- 374.30405 197.3
[M]+ 353.32883 204.2
[M]- 353.32993 204.2
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.