CID 10474509

162070-61-3

Structural Information

Molecular Formula
C25H27NO2
SMILES
CC(/C(=C(\C1=CC=CC=C1)/C2=CC=C(C=C2)OCCNC)/C3=CC=CC=C3)O
InChI
InChI=1S/C25H27NO2/c1-19(27)24(20-9-5-3-6-10-20)25(21-11-7-4-8-12-21)22-13-15-23(16-14-22)28-18-17-26-2/h3-16,19,26-27H,17-18H2,1-2H3/b25-24-
InChIKey
GREXPZNIZPCGIV-IZHYLOQSSA-N
Compound name
(E)-4-[4-[2-(methylamino)ethoxy]phenyl]-3,4-diphenylbut-3-en-2-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

15
Patents

373.2042 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.21148 195.5
[M+Na]+ 396.19342 208.7
[M+NH4]+ 391.23802 202.8
[M+K]+ 412.16736 200.1
[M-H]- 372.19692 202.0
[M+Na-2H]- 394.17887 205.1
[M]+ 373.20365 199.2
[M]- 373.20475 199.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe