| SpectraBase Spectrum ID |
BrrvN1NTJcH |
| Name |
3-(2',3'-Dihydroxy-3'-methylbutyl)-5-(3"-methylbutyl)indole |
| Alternate Name(s) |
1-(5-isopentyl-1H-indol-3-yl)-3-methyl-2,3-butanediol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H27NO2 |
| InChI |
InChI=1S/C18H27NO2/c1-12(2)5-6-13-7-8-16-15(9-13)14(11-19-16)10-17(20)18(3,4)21/h7-9,11-12,17,19-21H,5-6,10H2,1-4H3 |
| InChIKey |
JTGSGTOCWSEHDV-UHFFFAOYSA-N |
| Molecular Weight |
289.419 g/mol |
| SMILES |
[nH]1c2c(c(CC(C(O)(C)C)O)c1)cc(cc2)CCC(C)C |
| SPLASH |
splash10-0udi-0090000000-497c30c2ef0d630a94f5 |
| Source of Spectrum |
U-1995-1336-20 |
| Wiley ID |
767398 |
