CID 23466

Mebenil

Structural Information

Molecular Formula
C14H13NO
SMILES
CC1=CC=CC=C1C(=O)NC2=CC=CC=C2
InChI
InChI=1S/C14H13NO/c1-11-7-5-6-10-13(11)14(16)15-12-8-3-2-4-9-12/h2-10H,1H3,(H,15,16)
InChIKey
MZNCVTCEYXDDIS-UHFFFAOYSA-N
Compound name
2-methyl-N-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

16
References

7539
Patents

211.09972 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.10700 146.2
[M+Na]+ 234.08894 153.0
[M-H]- 210.09244 153.1
[M+NH4]+ 229.13354 164.5
[M+K]+ 250.06288 149.5
[M+H-H2O]+ 194.09698 138.9
[M+HCOO]- 256.09792 171.2
[M+CH3COO]- 270.11357 189.4
[M+Na-2H]- 232.07439 152.8
[M]+ 211.09917 145.0
[M]- 211.10027 145.0
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