CID 88828

N-hexadecylacrylamide

Structural Information

Molecular Formula
C19H37NO
SMILES
CCCCCCCCCCCCCCCCNC(=O)C=C
InChI
InChI=1S/C19H37NO/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-19(21)4-2/h4H,2-3,5-18H2,1H3,(H,20,21)
InChIKey
BKWMQCLROIZNLX-UHFFFAOYSA-N
Compound name
N-hexadecylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

471
Patents

295.2875 Da
Monoisotopic Mass

7.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.294776 182.7
[M+Na]+ 318.276718 184.1
[M-H]- 294.280224 180.6
[M+NH4]+ 313.321323 197.9
[M+K]+ 334.250658 180.1
[M+H-H2O]+ 278.284760 175.5
[M+HCOO]- 340.285701 202.9
[M+CH3COO]- 354.301351 211.6
[M+Na-2H]- 316.262166 181.8
[M]+ 295.28695142 187.5
[M]- 295.28804858 187.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe