SpectraBase Spectrum ID |
FylZZ5gG1LE |
Name |
5-Bromo-3-(ethoxymethyl)-1-[4-(p-methoxyphenoxy)-2-butynyl]-2-[(p-methoxyphenoxy)methyl]indole |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
563.130736065 u |
Formula |
C30H30BrNO5 |
InChI |
InChI=1S/C30H30BrNO5/c1-4-35-20-28-27-19-22(31)7-16-29(27)32(30(28)21-37-26-14-10-24(34-3)11-15-26)17-5-6-18-36-25-12-8-23(33-2)9-13-25/h7-16,19H,4,17-18,20-21H2,1-3H3 |
InChIKey |
KRYQBISPUXNKCZ-UHFFFAOYSA-N |
Molecular Weight |
564.476 g/mol |
SMILES |
C=12C=C(C=CC1N(C(=C2COCC)COC=1C=CC(=CC1)OC)CC#CCOC=1C=CC(=CC1)OC)Br |