CID 720716

N-(2,6-diisopropylphenyl)-2,6-dimethoxybenzamide

Structural Information

Molecular Formula
C21H27NO3
SMILES
CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C2=C(C=CC=C2OC)OC
InChI
InChI=1S/C21H27NO3/c1-13(2)15-9-7-10-16(14(3)4)20(15)22-21(23)19-17(24-5)11-8-12-18(19)25-6/h7-14H,1-6H3,(H,22,23)
InChIKey
NCZLVEWLTOQZKN-UHFFFAOYSA-N
Compound name
N-[2,6-di(propan-2-yl)phenyl]-2,6-dimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

341.1991 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.206376 184.0
[M+Na]+ 364.188318 189.6
[M-H]- 340.191824 190.7
[M+NH4]+ 359.232923 197.4
[M+K]+ 380.162258 187.1
[M+H-H2O]+ 324.196360 175.6
[M+HCOO]- 386.197301 204.8
[M+CH3COO]- 400.212951 219.9
[M+Na-2H]- 362.173766 182.3
[M]+ 341.19855142 188.1
[M]- 341.19964858 188.1
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.