CID 76959

4-methoxybenzamide

Structural Information

Molecular Formula
C8H9NO2
SMILES
COC1=CC=C(C=C1)C(=O)N
InChI
InChI=1S/C8H9NO2/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H2,9,10)
InChIKey
GUCPYIYFQVTFSI-UHFFFAOYSA-N
Compound name
4-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

14
References

5095
Patents

151.06332 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.07060 129.0
[M+Na]+ 174.05254 136.9
[M-H]- 150.05604 132.6
[M+NH4]+ 169.09714 149.7
[M+K]+ 190.02648 135.7
[M+H-H2O]+ 134.06058 123.3
[M+HCOO]- 196.06152 153.9
[M+CH3COO]- 210.07717 177.6
[M+Na-2H]- 172.03799 135.0
[M]+ 151.06277 128.7
[M]- 151.06387 128.7
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