CID 3066303

109920-83-4

Structural Information

Molecular Formula
C24H32N2O2
SMILES
CC(C)(C)NCC(COC1=CC=CC=C1CCCC2=C3C=CNC3=CC=C2)O
InChI
InChI=1S/C24H32N2O2/c1-24(2,3)26-16-20(27)17-28-23-13-5-4-8-19(23)11-6-9-18-10-7-12-22-21(18)14-15-25-22/h4-5,7-8,10,12-15,20,25-27H,6,9,11,16-17H2,1-3H3
InChIKey
NDWKYUROASQZKA-UHFFFAOYSA-N
Compound name
1-(tert-butylamino)-3-[2-[3-(1H-indol-4-yl)propyl]phenoxy]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

380.24637 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.25365 197.2
[M+Na]+ 403.23559 208.4
[M+NH4]+ 398.28019 203.6
[M+K]+ 419.20953 202.6
[M-H]- 379.23909 200.1
[M+Na-2H]- 401.22104 202.9
[M]+ 380.24582 199.6
[M]- 380.24692 199.6
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