CID 58974

N-(p-chlorobenzyl)nonanamide

Structural Information

Molecular Formula
C16H24ClNO
SMILES
CCCCCCCCC(=O)NCC1=CC=C(C=C1)Cl
InChI
InChI=1S/C16H24ClNO/c1-2-3-4-5-6-7-8-16(19)18-13-14-9-11-15(17)12-10-14/h9-12H,2-8,13H2,1H3,(H,18,19)
InChIKey
QMAOGFLUSMZBCK-UHFFFAOYSA-N
Compound name
N-[(4-chlorophenyl)methyl]nonanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.15463 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.161906 169.3
[M+Na]+ 304.143848 174.6
[M-H]- 280.147354 171.7
[M+NH4]+ 299.188453 186.0
[M+K]+ 320.117788 169.2
[M+H-H2O]+ 264.151890 162.9
[M+HCOO]- 326.152831 187.4
[M+CH3COO]- 340.168481 203.5
[M+Na-2H]- 302.129296 171.4
[M]+ 281.15408142 173.4
[M]- 281.15517858 173.4
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.