CID 94794

Dodecanamide, n-phenyl-

Structural Information

Molecular Formula
C18H29NO
SMILES
CCCCCCCCCCCC(=O)NC1=CC=CC=C1
InChI
InChI=1S/C18H29NO/c1-2-3-4-5-6-7-8-9-13-16-18(20)19-17-14-11-10-12-15-17/h10-12,14-15H,2-9,13,16H2,1H3,(H,19,20)
InChIKey
YGKDYOGEVVXBKW-UHFFFAOYSA-N
Compound name
N-phenyldodecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

577
Patents

275.2249 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.23218 172.1
[M+Na]+ 298.21412 174.8
[M-H]- 274.21762 173.9
[M+NH4]+ 293.25872 187.8
[M+K]+ 314.18806 171.0
[M+H-H2O]+ 258.22216 164.3
[M+HCOO]- 320.22310 194.1
[M+CH3COO]- 334.23875 204.7
[M+Na-2H]- 296.19957 174.4
[M]+ 275.22435 174.5
[M]- 275.22545 174.5
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

patents stripe