CID 56305

5-acetamido-3-methylacetanilide

Structural Information

Molecular Formula
C10H12N2O3
SMILES
CC1=CC(=CC(=C1O)C(=O)N)NC(=O)C
InChI
InChI=1S/C10H12N2O3/c1-5-3-7(12-6(2)13)4-8(9(5)14)10(11)15/h3-4,14H,1-2H3,(H2,11,15)(H,12,13)
InChIKey
APLIEPYNXJWBTI-UHFFFAOYSA-N
Compound name
5-acetamido-2-hydroxy-3-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.0848 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.092076 144.5
[M+Na]+ 231.074018 152.1
[M-H]- 207.077524 147.2
[M+NH4]+ 226.118623 162.3
[M+K]+ 247.047958 150.2
[M+H-H2O]+ 191.082060 138.6
[M+HCOO]- 253.083001 167.7
[M+CH3COO]- 267.098651 190.5
[M+Na-2H]- 229.059466 146.5
[M]+ 208.08425142 143.1
[M]- 208.08534858 143.1
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.