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]+ 290.211476 173.5
[M+Na]+ 312.193418 177.4
[M-H]- 288.196924 175.7
[M+NH4]+ 307.238023 188.8
[M+K]+ 328.167358 173.5
[M+H-H2O]+ 272.201460 165.7
[M+HCOO]- 334.202401 195.9
[M+CH3COO]- 348.218051 207.0
[M+Na-2H]- 310.178866 175.1
[M]+ 289.20365142 177.0
[M]- 289.20474858 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.