CID 43310311

2-[(3-aminophenyl)formamido]-n-methylacetamide

Structural Information

Molecular Formula
C10H13N3O2
SMILES
CNC(=O)CNC(=O)C1=CC(=CC=C1)N
InChI
InChI=1S/C10H13N3O2/c1-12-9(14)6-13-10(15)7-3-2-4-8(11)5-7/h2-5H,6,11H2,1H3,(H,12,14)(H,13,15)
InChIKey
NDFRECYDZQFIAD-UHFFFAOYSA-N
Compound name
3-amino-N-[2-(methylamino)-2-oxoethyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.10077 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.10805 145.6
[M+Na]+ 230.08999 151.0
[M-H]- 206.09349 148.9
[M+NH4]+ 225.13459 163.2
[M+K]+ 246.06393 149.3
[M+H-H2O]+ 190.09803 138.6
[M+HCOO]- 252.09897 171.1
[M+CH3COO]- 266.11462 192.7
[M+Na-2H]- 228.07544 149.8
[M]+ 207.10022 142.9
[M]- 207.10132 142.9
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

No patent data available for this compound.