CID 9834239

4-amino-5-chloro-2-methoxybenzamide

Structural Information

Molecular Formula
C8H9ClN2O2
SMILES
COC1=CC(=C(C=C1C(=O)N)Cl)N
InChI
InChI=1S/C8H9ClN2O2/c1-13-7-3-6(10)5(9)2-4(7)8(11)12/h2-3H,10H2,1H3,(H2,11,12)
InChIKey
BRXXTVNYHGGBKP-UHFFFAOYSA-N
Compound name
4-amino-5-chloro-2-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

95
Patents

200.03525 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.04253 138.8
[M+Na]+ 223.02447 150.5
[M+NH4]+ 218.06907 146.6
[M+K]+ 238.99841 145.5
[M-H]- 199.02797 141.1
[M+Na-2H]- 221.00992 144.3
[M]+ 200.03470 141.2
[M]- 200.03580 141.2
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

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