CID 3059508

O-methoxyphenylundecylenanilide

Structural Information

Molecular Formula
C18H27NO2
SMILES
COC1=CC=CC=C1NC(=O)CCCCCCCCC=C
InChI
InChI=1S/C18H27NO2/c1-3-4-5-6-7-8-9-10-15-18(20)19-16-13-11-12-14-17(16)21-2/h3,11-14H,1,4-10,15H2,2H3,(H,19,20)
InChIKey
GDLMMSIWAXMZCG-UHFFFAOYSA-N
Compound name
N-(2-methoxyphenyl)undec-10-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.2042 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.21148 173.5
[M+Na]+ 312.19342 177.4
[M-H]- 288.19692 175.7
[M+NH4]+ 307.23802 188.8
[M+K]+ 328.16736 173.5
[M+H-H2O]+ 272.20146 165.7
[M+HCOO]- 334.20240 195.9
[M+CH3COO]- 348.21805 207.0
[M+Na-2H]- 310.17887 175.1
[M]+ 289.20365 177.0
[M]- 289.20475 177.0
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

No patent data available for this compound.