| SpectraBase Spectrum ID |
AOjxwEMajTX |
| Name |
.gamma.-Oxo-3-methyl-1H-indole-1-butanoic acid |
| CAS Registry Number |
71382-21-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H13NO3 |
| InChI |
InChI=1S/C13H13NO3/c1-9-8-14(12(15)6-7-13(16)17)11-5-3-2-4-10(9)11/h2-5,8H,6-7H2,1H3,(H,16,17) |
| InChIKey |
USVBQTMUNCRXMZ-UHFFFAOYSA-N |
| Molecular Weight |
231.251 g/mol |
| SMILES |
OC(CCC([n]1cc(C)c2c1cccc2)=O)=O |
| SPLASH |
splash10-001i-0910000000-75910064d86c1449032a |
| Source of Spectrum |
J-44-3996-0 |
| Synonyms |
4-(3-methyl-1H-indol-1-yl)-4-oxobutanoic acid |
| Wiley ID |
1232752 |
