CID 28390825

N-ethyl-2-hydroxy-3-methylbenzamide

Structural Information

Molecular Formula
C10H13NO2
SMILES
CCNC(=O)C1=CC=CC(=C1O)C
InChI
InChI=1S/C10H13NO2/c1-3-11-10(13)8-6-4-5-7(2)9(8)12/h4-6,12H,3H2,1-2H3,(H,11,13)
InChIKey
HXQOINZDWMMGBM-UHFFFAOYSA-N
Compound name
N-ethyl-2-hydroxy-3-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

179.09464 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.10192 138.1
[M+Na]+ 202.08386 145.7
[M-H]- 178.08736 140.9
[M+NH4]+ 197.12846 157.6
[M+K]+ 218.05780 143.6
[M+H-H2O]+ 162.09190 132.5
[M+HCOO]- 224.09284 161.5
[M+CH3COO]- 238.10849 182.2
[M+Na-2H]- 200.06931 142.9
[M]+ 179.09409 137.9
[M]- 179.09519 137.9
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

patents stripe