| SpectraBase Spectrum ID |
ESXI3K9V1VH |
| Name |
t-Butyl 2,3-dioxo-3-(N-allylindol-3-yl)propionate monohydrate |
| Alternate Name(s) |
tert-Butyl 2,3-dioxo-3-[1-(prop-2-en-1-yl)-1H-indol-3-yl]propanoate hydrate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21NO5 |
| InChI |
InChI=1S/C18H19NO4.H2O/c1-5-10-19-11-13(12-8-6-7-9-14(12)19)15(20)16(21)17(22)23-18(2,3)4;/h5-9,11H,1,10H2,2-4H3;1H2 |
| InChIKey |
JTZVGDZGLXTIGL-UHFFFAOYSA-N |
| Molecular Weight |
331.368 g/mol |
| SMILES |
O.c1(c[n](CC=C)c2c1cccc2)C(C(C(OC(C)(C)C)=O)=O)=O |
| SPLASH |
splash10-001i-0900000000-0fcaa934d4694f440231 |
| Source of Spectrum |
H1-35-986-1 |
| Wiley ID |
755031 |
