| SpectraBase Compound ID | 1YLH88Oa0MH |
|---|---|
| InChI | InChI=1S/C18H22NO3/c1-20-14-9-12-10-19-8-7-11-5-4-6-13(16(11)19)15(12)18(22-3)17(14)21-2/h9-11H,4-8H2,1-3H3/q+1 |
| InChIKey | SZVZIZHXFGDJCS-UHFFFAOYSA-N |
| Mol Weight | 300.38 g/mol |
| Molecular Formula | C18H22NO3 |
| Exact Mass | 300.159969 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AR6vC44FAHv |
|---|---|
| Name | Roserine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H22NO3 |
| InChI | InChI=1S/C18H22NO3/c1-20-14-9-12-10-19-8-7-11-5-4-6-13(16(11)19)15(12)18(22-3)17(14)21-2/h9-11H,4-8H2,1-3H3/q+1 |
| InChIKey | SZVZIZHXFGDJCS-UHFFFAOYSA-N |
| Molecular Weight | 300.378 g/mol |
| SMILES | c12[n+]3CCC1CCCc2c1c(OC)c(c(cc1c3)OC)OC |
| SPLASH | splash10-00di-0290000000-4b43b5eac71814596c9b |
| Source of Spectrum | X2-55-136-1 |
| Wiley ID | 1604306 |