CID 81412

N-(2-methoxy-5-methylphenyl)acetamide

Structural Information

Molecular Formula
C10H13NO2
SMILES
CC1=CC(=C(C=C1)OC)NC(=O)C
InChI
InChI=1S/C10H13NO2/c1-7-4-5-10(13-3)9(6-7)11-8(2)12/h4-6H,1-3H3,(H,11,12)
InChIKey
POLMNXCVMYMLSF-UHFFFAOYSA-N
Compound name
N-(2-methoxy-5-methylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

82
Patents

179.09464 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.101916 137.3
[M+Na]+ 202.083858 145.4
[M-H]- 178.087364 141.6
[M+NH4]+ 197.128463 157.6
[M+K]+ 218.057798 144.2
[M+H-H2O]+ 162.091900 131.5
[M+HCOO]- 224.092841 162.3
[M+CH3COO]- 238.108491 184.8
[M+Na-2H]- 200.069306 142.7
[M]+ 179.09409142 139.1
[M]- 179.09518858 139.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe