CID 13086

Ameltolide

Structural Information

Molecular Formula
C15H16N2O
SMILES
CC1=C(C(=CC=C1)C)NC(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C15H16N2O/c1-10-4-3-5-11(2)14(10)17-15(18)12-6-8-13(16)9-7-12/h3-9H,16H2,1-2H3,(H,17,18)
InChIKey
HZIWGOAXOBPQGY-UHFFFAOYSA-N
Compound name
4-amino-N-(2,6-dimethylphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

30
References

356
Patents

240.12627 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.13355 156.5
[M+Na]+ 263.11549 169.8
[M+NH4]+ 258.16009 164.9
[M+K]+ 279.08943 162.6
[M-H]- 239.11899 162.1
[M+Na-2H]- 261.10094 165.2
[M]+ 240.12572 159.9
[M]- 240.12682 159.9
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