| SpectraBase Compound ID | C6FTn8bzPMN |
|---|---|
| InChI | InChI=1S/C18H21NO6/c1-21-10-4-12-18(17-16(10)25-17)9-3-11-15(24-7-23-11)14(22-2)8(9)5-19(12)6-13(18)20/h3,10,12-13,16-17,20H,4-7H2,1-2H3/t10-,12-,13+,16+,17+,18+/m1/s1 |
| InChIKey | GKZWOVRDMISXTE-XVOQKHCOSA-N |
| Mol Weight | 347.37 g/mol |
| Molecular Formula | C18H21NO6 |
| Exact Mass | 347.136887 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AJUQvUtlEhK |
|---|---|
| Name | Cavinine |
| Alternate Name(s) | Epoxyamabelline |
| CAS Registry Number | 58189-38-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H21NO6 |
| InChI | InChI=1S/C18H21NO6/c1-21-10-4-12-18(17-16(10)25-17)9-3-11-15(24-7-23-11)14(22-2)8(9)5-19(12)6-13(18)20/h3,10,12-13,16-17,20H,4-7H2,1-2H3/t10-,12-,13+,16+,17+,18+/m1/s1 |
| InChIKey | GKZWOVRDMISXTE-XVOQKHCOSA-N |
| Molecular Weight | 347.367 g/mol |
| SMILES | O[C@@]1([C@@]23[C@@]4([C@@](O4)([C@@](C[C@]2(N(C1)Cc1c3cc2c(OCO2)c1OC)[H])(OC)[H])[H])[H])[H] |
| SPLASH | splash10-014i-0049000000-9b3ca18c3980c70a61b8 |
| Source of Spectrum | W5-30712-0-0 |
| Wiley ID | 1339992 |