CID 213517

Methyl 2-(dimethylcarbamoyl)benzoate

Structural Information

Molecular Formula
C11H13NO3
SMILES
CN(C)C(=O)C1=CC=CC=C1C(=O)OC
InChI
InChI=1S/C11H13NO3/c1-12(2)10(13)8-6-4-5-7-9(8)11(14)15-3/h4-7H,1-3H3
InChIKey
HJPZFXYWMRWNHV-UHFFFAOYSA-N
Compound name
methyl 2-(dimethylcarbamoyl)benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.08954 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.09682 144.9
[M+Na]+ 230.07876 155.7
[M+NH4]+ 225.12336 152.0
[M+K]+ 246.05270 151.3
[M-H]- 206.08226 146.4
[M+Na-2H]- 228.06421 150.5
[M]+ 207.08899 146.6
[M]- 207.09009 146.6
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.