CID 16782469

2-amino-6-methylbenzamide

Structural Information

Molecular Formula
C8H10N2O
SMILES
CC1=C(C(=CC=C1)N)C(=O)N
InChI
InChI=1S/C8H10N2O/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4H,9H2,1H3,(H2,10,11)
InChIKey
IYKKLCLIASEVDG-UHFFFAOYSA-N
Compound name
2-amino-6-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

119
Patents

150.07932 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.08660 130.4
[M+Na]+ 173.06854 138.4
[M-H]- 149.07204 133.8
[M+NH4]+ 168.11314 150.9
[M+K]+ 189.04248 136.4
[M+H-H2O]+ 133.07658 124.7
[M+HCOO]- 195.07752 155.5
[M+CH3COO]- 209.09317 181.1
[M+Na-2H]- 171.05399 134.8
[M]+ 150.07877 127.2
[M]- 150.07987 127.2
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

patents stripe