SpectraBase Compound ID | 7IlZd19BPVD |
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InChI | InChI=1S/C15H24O4/c1-9-5-10(18)11-12(15(9,19)8-17)14(4,7-16)6-13(11,2)3/h9,16-17,19H,5-8H2,1-4H3/t9-,14-,15-/m1/s1/i7D,8D/t7?,8?,9-,14-,15- |
InChIKey | XQJKUGCSOUECNY-BWBPLWDLSA-N |
Mol Weight | 270.37 g/mol |
Molecular Formula | C15H222D2O4 |
Exact Mass | 270.180013 g/mol |
SpectraBase Spectrum ID | CnxgdtsYpCv |
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Name | 1-Hydroxy-4-oxo-[10-2H,15-2H]botry-5(9)endiol |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C15H22D2O4 |
InChI | InChI=1S/C15H24O4/c1-9-5-10(18)11-12(15(9,19)8-17)14(4,7-16)6-13(11,2)3/h9,16-17,19H,5-8H2,1-4H3/t9-,14-,15-/m1/s1/i7D,8D/t7?,8?,9-,14-,15- |
InChIKey | XQJKUGCSOUECNY-BWBPLWDLSA-N |
Molecular Weight | 270.365 g/mol |
SMILES | OC([C@]1(CC(C2=C1[C@@](C(O)[2D])([C@@](CC2=O)(C)[H])O)(C)C)C)[2D] |
SPLASH | splash10-00dr-0090000000-f1621682a4010638bd43 |
Source of Spectrum | F-62-8260-16 |
Wiley ID | 1640532 |