CID 4293119

N-(2-aminophenyl)-n-methylacetamide

Structural Information

Molecular Formula
C9H12N2O
SMILES
CC(=O)N(C)C1=CC=CC=C1N
InChI
InChI=1S/C9H12N2O/c1-7(12)11(2)9-6-4-3-5-8(9)10/h3-6H,10H2,1-2H3
InChIKey
BCDLBZFBGPAGIA-UHFFFAOYSA-N
Compound name
N-(2-aminophenyl)-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

164.09496 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.102236 134.9
[M+Na]+ 187.084178 141.8
[M-H]- 163.087684 139.9
[M+NH4]+ 182.128783 155.5
[M+K]+ 203.058118 141.3
[M+H-H2O]+ 147.092220 128.6
[M+HCOO]- 209.093161 160.9
[M+CH3COO]- 223.108811 186.3
[M+Na-2H]- 185.069626 139.9
[M]+ 164.09441142 134.0
[M]- 164.09550858 134.0
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