CID 6447079

2-propenamide, 3-(1h-indol-3-yl)-n-(3-(phenylmethoxy)phenyl)-, (e)-

Structural Information

Molecular Formula
C24H20N2O2
SMILES
C1=CC=C(C=C1)COC2=CC=CC(=C2)NC(=O)/C=C/C3=CNC4=CC=CC=C43
InChI
InChI=1S/C24H20N2O2/c27-24(14-13-19-16-25-23-12-5-4-11-22(19)23)26-20-9-6-10-21(15-20)28-17-18-7-2-1-3-8-18/h1-16,25H,17H2,(H,26,27)/b14-13+
InChIKey
XEMABSMSQXQAOY-BUHFOSPRSA-N
Compound name
(E)-3-(1H-indol-3-yl)-N-(3-phenylmethoxyphenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

368.15247 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.159746 188.1
[M+Na]+ 391.141688 194.4
[M-H]- 367.145194 196.0
[M+NH4]+ 386.186293 200.0
[M+K]+ 407.115628 186.6
[M+H-H2O]+ 351.149730 178.0
[M+HCOO]- 413.150671 210.2
[M+CH3COO]- 427.166321 197.6
[M+Na-2H]- 389.127136 192.0
[M]+ 368.15192142 188.2
[M]- 368.15301858 188.2
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.