| SpectraBase Compound ID | GtfOlB1LYSG |
|---|---|
| InChI | InChI=1S/C18H21NO5/c1-19-9-18(20)17(4-3-12(21-2)6-16(17)19)13-7-15-14(22-10-23-15)5-11(13)8-24-18/h3-5,7,12,16,20H,6,8-10H2,1-2H3/t12-,16+,17+,18+/m1/s1 |
| InChIKey | YLWAQARRNQVEHD-IEGACIPQSA-N |
| Mol Weight | 331.37 g/mol |
| Molecular Formula | C18H21NO5 |
| Exact Mass | 331.141973 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Ad1spiNaFMZ |
|---|---|
| Name | Tazettine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H21NO5 |
| InChI | InChI=1S/C18H21NO5/c1-19-9-18(20)17(4-3-12(21-2)6-16(17)19)13-7-15-14(22-10-23-15)5-11(13)8-24-18/h3-5,7,12,16,20H,6,8-10H2,1-2H3/t12-,16+,17+,18+/m1/s1 |
| InChIKey | YLWAQARRNQVEHD-IEGACIPQSA-N |
| Instrument Name | Agilent 7890A-Quad 7000 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/pca.2865 |
| Molecular Weight | 331.368 g/mol |
| SMILES | O[C@@]12CN([C@]3(C[C@](OC)(C=C[C@@]23c2c(CO1)cc1OCOc1c2)[H])[H])C |
| SPLASH | splash10-0002-0391000000-18dada73922c9ff2773d |
| Source of Spectrum | PA-31-51-21 |
| Wiley ID | 1840314 |