| SpectraBase Compound ID | 7HlyicaqDlk |
|---|---|
| InChI | InChI=1S/C17H27NO2/c1-13(6-7-14(2)12-19)9-15-10-17(3,20)16-5-4-8-18(16)11-15/h7,9,12-13,16,20H,4-6,8,10-11H2,1-3H3/b14-7-,15-9-/t13-,16?,17+/m1/s1 |
| InChIKey | UMFFCVOPQACNIU-NGTDQNBQSA-N |
| Mol Weight | 277.41 g/mol |
| Molecular Formula | C17H27NO2 |
| Exact Mass | 277.204179 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 95upZ4Sew4Q |
|---|---|
| Name | Pumiliotoxin A - Cpd. |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H27NO2 |
| InChI | InChI=1S/C17H27NO2/c1-13(6-7-14(2)12-19)9-15-10-17(3,20)16-5-4-8-18(16)11-15/h7,9,12-13,16,20H,4-6,8,10-11H2,1-3H3/b14-7-,15-9-/t13-,16?,17+/m1/s1 |
| InChIKey | UMFFCVOPQACNIU-NGTDQNBQSA-N |
| Molecular Weight | 277.408 g/mol |
| SMILES | O[C@@]1(C2N(C\C(C1)=C/[C@@](C\C=C/(C=O)C)(C)[H])CCC2)C |
| SPLASH | splash10-01vo-5900000000-ccfe0692c530942f1512 |
| Source of Spectrum | X2-53-412-277 |
| Wiley ID | 1603440 |