| SpectraBase Compound ID | FpmOJC4W6Bh |
|---|---|
| InChI | InChI=1S/C22H36N2O5/c1-14-7-5-9-15(2)18(25)19-16(22(20(26)28-4)11-12-23-24-22)13-17(29-19)21(3,27)10-6-8-14/h8,15-19,25,27H,5-7,9-13H2,1-4H3/b14-8+/t15-,16-,17+,18+,19-,21-,22-/m1/s1 |
| InChIKey | FKDPUCHIQWGBOO-LOAXDODDSA-N |
| Mol Weight | 408.5 g/mol |
| Molecular Formula | C22H36N2O5 |
| Exact Mass | 408.262422 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KBP04EK5ssC |
|---|---|
| Name | Euliolide-15-spiro-3'-pyrazoline |
| Alternate Name(s) | (5R)-5-[(1S,2R,5E,10R,11S,12R,13S)-2,11-dihydroxy-2,6,10-trimethyl-15-oxabicyclo[10.2.1]pentadec-5-en-13-yl]-3,4-dihydropyrazole-5-carboxylic acid methyl ester methyl (5R)-5-[(1S,2R,5E,10R,11S,12R,13S)-2,11-dihydroxy-2,6,10-trimethyl-15-oxabicyclo[10.2.1]pentadec-5-en-13-yl]-3,4-dihydropyrazole-5-carboxylate methyl (5R)-5-[(1S,2R,5E,10R,11S,12R,13S)-2,6,10-trimethyl-2,11-bis(oxidanyl)-15-oxabicyclo[10.2.1]pentadec-5-en-13-yl]-3,4-dihydropyrazole-5-carboxylate |
| Comments | Removed - expert review: contamination (chloroform)) |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H36N2O5 |
| InChI | InChI=1S/C22H36N2O5/c1-14-7-5-9-15(2)18(25)19-16(22(20(26)28-4)11-12-23-24-22)13-17(29-19)21(3,27)10-6-8-14/h8,15-19,25,27H,5-7,9-13H2,1-4H3/b14-8+/t15-,16-,17+,18+,19-,21-,22-/m1/s1 |
| InChIKey | FKDPUCHIQWGBOO-LOAXDODDSA-N |
| Molecular Weight | 408.539 g/mol |
| SMILES | O[C@]1([C@@]2(C[C@]([C@]([C@]([C@@](CCC\C(=C\CC1)C)(C)[H])(O)[H])(O2)[H])([C@@]1(N=NCC1)C(=O)OC)[H])[H])C |
| SPLASH | splash10-001r-9000000000-5d35b8e0a5ec22d387f8 |
| Source of Spectrum | J-66-656-25 |
| Wiley ID | 1534318 |