CID 24834806

Benactizina n. 43

Structural Information

Molecular Formula
C24H25NO3
SMILES
CN(C)CC(C1=CC=CC=C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C24H25NO3/c1-25(2)18-22(19-12-6-3-7-13-19)28-23(26)24(27,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-17,22,27H,18H2,1-2H3
InChIKey
DLCLQPSAMLSUDP-UHFFFAOYSA-N
Compound name
[2-(dimethylamino)-1-phenylethyl] 2-hydroxy-2,2-diphenylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

375.18344 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 376.19072 192.3
[M+Na]+ 398.17266 205.0
[M+NH4]+ 393.21726 199.4
[M+K]+ 414.14660 198.1
[M-H]- 374.17616 198.2
[M+Na-2H]- 396.15811 202.7
[M]+ 375.18289 195.9
[M]- 375.18399 195.9
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.