| SpectraBase Compound ID | 7S4yshzEScQ |
|---|---|
| InChI | InChI=1S/C22H29NO3/c1-13-6-5-7-18-21(13,3)9-8-14(2)22(18,4)11-15-19(25)17(24)10-16-20(15)26-12-23-16/h6,10,12,14,18,24-25H,5,7-9,11H2,1-4H3/t14-,18-,21+,22+/m0/s1 |
| InChIKey | PKFRXFDKJHUTSK-XLIQEIGGSA-N |
| Mol Weight | 355.48 g/mol |
| Molecular Formula | C22H29NO3 |
| Exact Mass | 355.214744 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GXRqVCHYCO8 |
|---|---|
| Name | Nakijinol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H29NO3 |
| InChI | InChI=1S/C22H29NO3/c1-13-6-5-7-18-21(13,3)9-8-14(2)22(18,4)11-15-19(25)17(24)10-16-20(15)26-12-23-16/h6,10,12,14,18,24-25H,5,7-9,11H2,1-4H3/t14-,18-,21+,22+/m0/s1 |
| InChIKey | PKFRXFDKJHUTSK-XLIQEIGGSA-N |
| Molecular Weight | 355.478 g/mol |
| SMILES | Oc1c(cc2c(c1C[C@]1([C@@]3([C@](C(=CCC3)C)(C)CC[C@@]1(C)[H])[H])C)ocn2)O |
| SPLASH | splash10-00kb-9900000000-63b06d48a14ae1db5321 |
| Source of Spectrum | AT-36-5590-1 |
| Wiley ID | 853294 |