CID 199586

O-toluamide, n-((dimethylcarbamoyl)methyl)-

Structural Information

Molecular Formula
C12H16N2O2
SMILES
CC1=CC=CC=C1C(=O)NCC(=O)N(C)C
InChI
InChI=1S/C12H16N2O2/c1-9-6-4-5-7-10(9)12(16)13-8-11(15)14(2)3/h4-7H,8H2,1-3H3,(H,13,16)
InChIKey
ZAKGCZIEMAQLGD-UHFFFAOYSA-N
Compound name
N-[2-(dimethylamino)-2-oxoethyl]-2-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.12119 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.12847 150.6
[M+Na]+ 243.11041 156.2
[M-H]- 219.11391 155.6
[M+NH4]+ 238.15501 169.1
[M+K]+ 259.08435 155.8
[M+H-H2O]+ 203.11845 143.6
[M+HCOO]- 265.11939 175.6
[M+CH3COO]- 279.13504 197.5
[M+Na-2H]- 241.09586 153.8
[M]+ 220.12064 151.8
[M]- 220.12174 151.8
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.