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

0
Patents

340.2151 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.22238 186.1
[M+Na]+ 363.20432 189.2
[M-H]- 339.20782 193.4
[M+NH4]+ 358.24892 199.2
[M+K]+ 379.17826 187.3
[M+H-H2O]+ 323.21236 176.9
[M+HCOO]- 385.21330 208.2
[M+CH3COO]- 399.22895 223.8
[M+Na-2H]- 361.18977 185.3
[M]+ 340.21455 188.4
[M]- 340.21565 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