CID 5058515

N-isopropyl-2-methyl-n-phenylbenzamide

Structural Information

Molecular Formula
C17H19NO
SMILES
CC1=CC=CC=C1C(=O)N(C2=CC=CC=C2)C(C)C
InChI
InChI=1S/C17H19NO/c1-13(2)18(15-10-5-4-6-11-15)17(19)16-12-8-7-9-14(16)3/h4-13H,1-3H3
InChIKey
BUTWMLBZVOLWPQ-UHFFFAOYSA-N
Compound name
2-methyl-N-phenyl-N-propan-2-ylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.14667 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.153946 160.1
[M+Na]+ 276.135888 165.4
[M-H]- 252.139394 167.9
[M+NH4]+ 271.180493 177.1
[M+K]+ 292.109828 163.1
[M+H-H2O]+ 236.143930 152.1
[M+HCOO]- 298.144871 183.4
[M+CH3COO]- 312.160521 202.7
[M+Na-2H]- 274.121336 163.0
[M]+ 253.14612142 160.6
[M]- 253.14721858 160.6
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

No patent data available for this compound.