SpectraBase Spectrum ID |
AfndQ8Q9EO0 |
Name |
Methyl 2-[3'-oxo-2'-(2",3"-dideuterio)pent-2"-enyl)cyclopent-1'-enyl]actate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H16D2O3 |
InChI |
InChI=1S/C13H18O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5H,3,6-9H2,1-2H3/b5-4+/i4D,5D |
InChIKey |
PYCUPWADDRWLFR-AXXYTVHGSA-N |
Molecular Weight |
224.296 g/mol |
SMILES |
C1(=C(C(=O)CC1)C\C(=C\(CC)[2D])[2D])CC(=O)OC |
SPLASH |
splash10-0zmj-2910000000-b712281b154d46729836 |
Source of Spectrum |
H-80-849-0 |
Wiley ID |
1222692 |