CID 5827

N-(4-methoxyphenyl)acetamide

Structural Information

Molecular Formula
C9H11NO2
SMILES
CC(=O)NC1=CC=C(C=C1)OC
InChI
InChI=1S/C9H11NO2/c1-7(11)10-8-3-5-9(12-2)6-4-8/h3-6H,1-2H3,(H,10,11)
InChIKey
XVAIDCNLVLTVFM-UHFFFAOYSA-N
Compound name
N-(4-methoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

128
References

2068
Patents

165.07898 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.086256 133.2
[M+Na]+ 188.068198 140.8
[M-H]- 164.071704 137.3
[M+NH4]+ 183.112803 153.8
[M+K]+ 204.042138 139.8
[M+H-H2O]+ 148.076240 127.4
[M+HCOO]- 210.077181 158.6
[M+CH3COO]- 224.092831 180.6
[M+Na-2H]- 186.053646 139.8
[M]+ 165.07843142 134.3
[M]- 165.07952858 134.3
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