CID 205495

Sa 66

Structural Information

Molecular Formula
C21H28N2O2
SMILES
CC1=C(C(=CC=C1)C)N(CCCN(C)C)C(=O)C(C2=CC=CC=C2)O
InChI
InChI=1S/C21H28N2O2/c1-16-10-8-11-17(2)19(16)23(15-9-14-22(3)4)21(25)20(24)18-12-6-5-7-13-18/h5-8,10-13,20,24H,9,14-15H2,1-4H3
InChIKey
VAYJJJUFVVFWPA-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]-N-(2,6-dimethylphenyl)-2-hydroxy-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

340.2151 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.222376 186.1
[M+Na]+ 363.204318 189.2
[M-H]- 339.207824 193.4
[M+NH4]+ 358.248923 199.2
[M+K]+ 379.178258 187.3
[M+H-H2O]+ 323.212360 176.9
[M+HCOO]- 385.213301 208.2
[M+CH3COO]- 399.228951 223.8
[M+Na-2H]- 361.189766 185.3
[M]+ 340.21455142 188.4
[M]- 340.21564858 188.4
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