CID 53923798

4-amino-3-methoxybenzamide

Structural Information

Molecular Formula
C8H10N2O2
SMILES
COC1=C(C=CC(=C1)C(=O)N)N
InChI
InChI=1S/C8H10N2O2/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4H,9H2,1H3,(H2,10,11)
InChIKey
IMIFTBDWIPJACS-UHFFFAOYSA-N
Compound name
4-amino-3-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

220
Patents

166.07423 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.08151 133.3
[M+Na]+ 189.06345 141.2
[M-H]- 165.06695 136.7
[M+NH4]+ 184.10805 153.0
[M+K]+ 205.03739 139.7
[M+H-H2O]+ 149.07149 127.3
[M+HCOO]- 211.07243 158.6
[M+CH3COO]- 225.08808 183.3
[M+Na-2H]- 187.04890 137.7
[M]+ 166.07368 131.6
[M]- 166.07478 131.6
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