| SpectraBase Spectrum ID |
7ImNxECRI0v |
| Name |
Metachromin C - acetate |
| Alternate Name(s) |
2-[(2E)-5-(1,3-dimethyl-2-methylenecyclohexyl)-3-methyl-2-pentenyl]-4-methoxy-3,6-dioxo-1,4-cyclohexadien-1-yl acetate
3-Acetoxy-1-[5'-(1'',2'',3''-trimethylcyclohex-3''-en-1''-yl)-3'-methylpent-2'-en-1'-yl]-6-methoxy-1,4-benzoquinone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H32O5 |
| InChI |
InChI=1S/C24H32O5/c1-15(11-13-24(5)12-7-8-16(2)17(24)3)9-10-19-22(27)21(28-6)14-20(26)23(19)29-18(4)25/h9,14,16H,3,7-8,10-13H2,1-2,4-6H3/b15-9+ |
| InChIKey |
XLSCVLWSDRTUKF-OQLLNIDSSA-N |
| Molecular Weight |
400.515 g/mol |
| SMILES |
C1(=C(C(=O)C=C(C1=O)OC)OC(=O)C)C\C=C\(CCC1(C(=C)C(C)CCC1)C)C |
| SPLASH |
splash10-0a4j-0494200000-80d89568ac59ce457622 |
| Source of Spectrum |
X2-52-1175-2 |
| Wiley ID |
1603319 |
