CID 101232

N-butyl-2,2-diphenylacetamide

Structural Information

Molecular Formula
C18H21NO
SMILES
CCCCNC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C18H21NO/c1-2-3-14-19-18(20)17(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3,(H,19,20)
InChIKey
DWTFZCMKNAQOCN-UHFFFAOYSA-N
Compound name
N-butyl-2,2-diphenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

267.16232 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.16960 166.3
[M+Na]+ 290.15154 179.1
[M+NH4]+ 285.19614 174.7
[M+K]+ 306.12548 170.7
[M-H]- 266.15504 171.4
[M+Na-2H]- 288.13699 175.4
[M]+ 267.16177 169.6
[M]- 267.16287 169.6
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