| SpectraBase Spectrum ID |
Hu62EuLoJs8 |
| Name |
2-Anthraceneacetic acid, 3-(cyanoacetyl)-9,10-dihydro-4-hydroxy-10-oxo-, 1,1-dimethylethyl ester |
| Alternate Name(s) |
1-Hydroxy-2-acetyl-3-(t-butyloxycarbonylmethyl)-8-cyano-10-hydro-anthrace-9-one
tert-Butyl (3-acetyl-5-cyano-4-hydroxy-10-oxo-9,10-dihydro-2-anthracenyl)acetate |
| CAS Registry Number |
115706-56-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H21NO5 |
| InChI |
InChI=1S/C23H21NO5/c1-12(25)18-16(10-17(26)29-23(2,3)4)9-15-8-13-6-5-7-14(11-24)19(13)22(28)20(15)21(18)27/h5-7,9,27H,8,10H2,1-4H3 |
| InChIKey |
MCISFDSZMUKYMB-UHFFFAOYSA-N |
| Molecular Weight |
391.423 g/mol |
| SMILES |
Oc1c2C(c3c(C#N)cccc3Cc2cc(CC(OC(C)(C)C)=O)c1C(=O)C)=O |
| SPLASH |
splash10-052f-9010000000-3c33f4f309db6c867616 |
| Source of Spectrum |
C-110-6185-29 |
| Wiley ID |
1365388 |
