CID 4059242

882748-24-5

Structural Information

Molecular Formula
C25H27NO
SMILES
CCC(C)C1=CC=C(C=C1)NCCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C25H27NO/c1-3-19(2)20-13-15-24(16-14-20)26-18-17-25(27)23-11-9-22(10-12-23)21-7-5-4-6-8-21/h4-16,19,26H,3,17-18H2,1-2H3
InChIKey
RMPNEASBZUDPGV-UHFFFAOYSA-N
Compound name
3-(4-butan-2-ylanilino)-1-(4-phenylphenyl)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

357.20926 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.21654 192.1
[M+Na]+ 380.19848 207.1
[M+NH4]+ 375.24308 200.5
[M+K]+ 396.17242 197.0
[M-H]- 356.20198 199.9
[M+Na-2H]- 378.18393 202.9
[M]+ 357.20871 196.6
[M]- 357.20981 196.6
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.