CID 4305689

2,2',4',6'-tetramethylbenzanilide

Structural Information

Molecular Formula
C17H19NO
SMILES
CC1=CC=CC=C1C(=O)NC2=C(C=C(C=C2C)C)C
InChI
InChI=1S/C17H19NO/c1-11-9-13(3)16(14(4)10-11)18-17(19)15-8-6-5-7-12(15)2/h5-10H,1-4H3,(H,18,19)
InChIKey
BXCRFYGVKKMPDC-UHFFFAOYSA-N
Compound name
2-methyl-N-(2,4,6-trimethylphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

253.14667 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.15395 159.1
[M+Na]+ 276.13589 167.4
[M-H]- 252.13939 166.5
[M+NH4]+ 271.18049 176.6
[M+K]+ 292.10983 163.3
[M+H-H2O]+ 236.14393 151.8
[M+HCOO]- 298.14487 182.9
[M+CH3COO]- 312.16052 202.0
[M+Na-2H]- 274.12134 161.9
[M]+ 253.14612 160.2
[M]- 253.14722 160.2
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