| SpectraBase Spectrum ID |
4HAkC5gIpCC |
| Name |
3-Methyl-3-[2'-methyl-3'-(1'',3''-butylenedioxy)-1'-butenyl]-4-(ethoxycarbonyl)-5-acetoxycyclohexan-1-one2-butanone |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32O7 |
| InChI |
InChI=1S/C21H32O7/c1-7-25-19(24)18-17(27-15(4)22)10-16(23)12-20(18,5)11-13(2)21(6)26-9-8-14(3)28-21/h11,14,17-18H,7-10,12H2,1-6H3/b13-11+/t14-,17?,18?,20?,21+/m0/s1 |
| InChIKey |
VQQQRQVKYQWNNB-ACCUITESSA-N |
| Molecular Weight |
396.480 g/mol |
| SMILES |
C1(C(C(OC(=O)C)CC(C1)=O)C(=O)OCC)(\C=C\([C@]1(O[C@@](C)(CCO1)[H])C)C)C |
| SPLASH |
splash10-00b9-0923000000-bdf502434b63c99e5d1a |
| Source of Spectrum |
Y4-83-51-27 |
| Wiley ID |
1549952 |
![3-Methyl-3-[2'-methyl-3'-(1'',3''-butylenedioxy)-1'-butenyl]-4-(ethoxycarbonyl)-5-acetoxycyclohexan-1-one2-butanone](/api/spectrum/4HAkC5gIpCC/structure.png?h=300&w=458 "3-Methyl-3-[2'-methyl-3'-(1'',3''-butylenedioxy)-1'-butenyl]-4-(ethoxycarbonyl)-5-acetoxycyclohexan-1-one2-butanone")
