CID 28463

Sa 65

Structural Information

Molecular Formula
C27H32N2O
SMILES
CC1=C(C(=CC=C1)C)N(CCCN(C)C)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C27H32N2O/c1-21-13-11-14-22(2)26(21)29(20-12-19-28(3)4)27(30)25(23-15-7-5-8-16-23)24-17-9-6-10-18-24/h5-11,13-18,25H,12,19-20H2,1-4H3
InChIKey
OYESUEDHZYJGGS-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]-N-(2,6-dimethylphenyl)-2,2-diphenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

400.25146 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.25874 203.8
[M+Na]+ 423.24068 205.8
[M-H]- 399.24418 214.7
[M+NH4]+ 418.28528 214.4
[M+K]+ 439.21462 202.3
[M+H-H2O]+ 383.24872 192.4
[M+HCOO]- 445.24966 226.2
[M+CH3COO]- 459.26531 237.5
[M+Na-2H]- 421.22613 202.7
[M]+ 400.25091 205.8
[M]- 400.25201 205.8
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.