CID 58978

N-(m-methoxybenzyl)nonanamide

Structural Information

Molecular Formula
C17H27NO2
SMILES
CCCCCCCCC(=O)NCC1=CC(=CC=C1)OC
InChI
InChI=1S/C17H27NO2/c1-3-4-5-6-7-8-12-17(19)18-14-15-10-9-11-16(13-15)20-2/h9-11,13H,3-8,12,14H2,1-2H3,(H,18,19)
InChIKey
VSFPQNVDTDNZRO-UHFFFAOYSA-N
Compound name
N-[(3-methoxyphenyl)methyl]nonanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

277.2042 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.21148 170.4
[M+Na]+ 300.19342 174.4
[M-H]- 276.19692 172.8
[M+NH4]+ 295.23802 186.3
[M+K]+ 316.16736 171.4
[M+H-H2O]+ 260.20146 162.8
[M+HCOO]- 322.20240 192.9
[M+CH3COO]- 336.21805 204.8
[M+Na-2H]- 298.17887 172.5
[M]+ 277.20365 174.3
[M]- 277.20475 174.3
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

No patent data available for this compound.