SpectraBase Compound ID | KbvyD6HU2O9 |
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InChI | InChI=1S/C22H28O3/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21)12-8-19(24)25-22/h3-4,13,16-18H,5-12H2,1-2H3/t16-,17+,18+,20+,21+,22-/m1/s1 |
InChIKey | UJVLDDZCTMKXJK-WNHSNXHDSA-N |
Mol Weight | 340.46 g/mol |
Molecular Formula | C22H28O3 |
Exact Mass | 340.203845 g/mol |
SpectraBase Spectrum ID | KMebGzH9s3d |
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Name | Canrenone |
Catalog Number | 21307 |
CAS Registry Number | 976-71-6 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C22H28O3 |
InChI | InChI=1S/C22H28O3/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21)12-8-19(24)25-22/h3-4,13,16-18H,5-12H2,1-2H3/t16-,17+,18+,20+,21+,22-/m1/s1 |
InChIKey | UJVLDDZCTMKXJK-WNHSNXHDSA-N |
Molecular Weight | 340.463 g/mol |
SMILES | C1C(C=C2[C@](C1)([C@@]1([C@@](C=C2)([C@]2([C@](CC1)([C@]1(CC2)OC(CC1)=O)C)[H])[H])[H])C)=O |
SPLASH | splash10-014l-4931000000-19d500b35abae1fea048 |
Source of Spectrum | CAY-2023-462-0 |
Wiley ID | 1888427 |