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
3
Annotation Hits

0
References

113
Patents

361.29807 Da
Monoisotopic Mass

8.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.305346 198.4
[M+Na]+ 384.287288 199.5
[M-H]- 360.290794 199.1
[M+NH4]+ 379.331893 210.4
[M+K]+ 400.261228 195.2
[M+H-H2O]+ 344.295330 189.7
[M+HCOO]- 406.296271 217.2
[M+CH3COO]- 420.311921 223.5
[M+Na-2H]- 382.272736 195.0
[M]+ 361.29752142 202.9
[M]- 361.29861858 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