CID 18740353

2-(2-hexyldecyloxy)benzamide

Structural Information

Molecular Formula
C23H39NO2
SMILES
CCCCCCCCC(CCCCCC)COC1=CC=CC=C1C(=O)N
InChI
InChI=1S/C23H39NO2/c1-3-5-7-9-10-12-16-20(15-11-8-6-4-2)19-26-22-18-14-13-17-21(22)23(24)25/h13-14,17-18,20H,3-12,15-16,19H2,1-2H3,(H2,24,25)
InChIKey
CMQJSECIJIYKFU-UHFFFAOYSA-N
Compound name
2-(2-hexyldecoxy)benzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

92
Patents

361.29807 Da
Monoisotopic Mass

8.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.30535 198.4
[M+Na]+ 384.28729 199.5
[M-H]- 360.29079 199.1
[M+NH4]+ 379.33189 210.4
[M+K]+ 400.26123 195.2
[M+H-H2O]+ 344.29533 189.7
[M+HCOO]- 406.29627 217.2
[M+CH3COO]- 420.31192 223.5
[M+Na-2H]- 382.27274 195.0
[M]+ 361.29752 202.9
[M]- 361.29862 202.9
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

patents stripe