| SpectraBase Spectrum ID |
1iw5Qndyfeb |
| Name |
3,3-Ethylendioxy-estr-5(10)-en-17-one |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
316.203844759 u |
| Formula |
C20H28O3 |
| InChI |
InChI=1S/C20H28O3/c1-19-8-6-15-14-7-9-20(22-10-11-23-20)12-13(14)2-3-16(15)17(19)4-5-18(19)21/h15-17H,2-12H2,1H3/t15?,16?,17?,19-/m0/s1 |
| InChIKey |
PHKKRZJWUGAFPF-QMUDONBSSA-N |
| Molecular Weight |
316.441 g/mol |
| Nominal Mass |
316 u |
| Number of Peaks |
41 |
| SMILES |
C1OC2(OC1)CC=1CCC3C4CCC(=O)[C@@]4(C)CCC3C1CC2 |
| SPLASH |
splash10-000i-9222000000-6fc775a54f2263976dcf |
| Source File Reference |
DSHS_50_0501 |
| Source of Spectrum |
Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany |
| Wiley ID |
50_501 |
