CID 59222

N-(p-bromobenzyl)dodecanamide

Structural Information

Molecular Formula
C19H30BrNO
SMILES
CCCCCCCCCCCC(=O)NCC1=CC=C(C=C1)Br
InChI
InChI=1S/C19H30BrNO/c1-2-3-4-5-6-7-8-9-10-11-19(22)21-16-17-12-14-18(20)15-13-17/h12-15H,2-11,16H2,1H3,(H,21,22)
InChIKey
RHZNVXZLSJAYSK-UHFFFAOYSA-N
Compound name
N-[(4-bromophenyl)methyl]dodecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

367.1511 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.15838 185.5
[M+Na]+ 390.14032 186.5
[M+NH4]+ 385.18492 188.8
[M+K]+ 406.11426 183.9
[M-H]- 366.14382 186.1
[M+Na-2H]- 388.12577 186.6
[M]+ 367.15055 184.5
[M]- 367.15165 184.5
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.