| SpectraBase Compound ID | 8rQIleQrWza |
|---|---|
| InChI | InChI=1S/C17H19NO3/c1-21-16-8-11-4-6-18-7-5-12-2-3-13(19)10-17(12,18)14(11)9-15(16)20/h2-3,5,8-9,13,19-20H,4,6-7,10H2,1H3/t13-,17?/m0/s1 |
| InChIKey | HBCNXWUNPXIERK-CWQZNGJJSA-N |
| Mol Weight | 285.34 g/mol |
| Molecular Formula | C17H19NO3 |
| Exact Mass | 285.136493 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FcQccFWqPJn |
|---|---|
| Name | Erysoline |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H19NO3 |
| InChI | InChI=1S/C17H19NO3/c1-21-16-8-11-4-6-18-7-5-12-2-3-13(19)10-17(12,18)14(11)9-15(16)20/h2-3,5,8-9,13,19-20H,4,6-7,10H2,1H3/t13-,17?/m0/s1 |
| InChIKey | HBCNXWUNPXIERK-CWQZNGJJSA-N |
| Molecular Weight | 285.343 g/mol |
| SMILES | Oc1c(cc2c(C34C(C=C[C@@](C4)(O)[H])=CCN3CC2)c1)OC |
| SPLASH | splash10-014r-0090000000-fd495caa2ba8ed882068 |
| Source of Spectrum | X2-54-333-8 |
| Wiley ID | 1603873 |