| SpectraBase Compound ID | 5PT67w2cq1o |
|---|---|
| InChI | InChI=1S/C27H45NO7/c1-8-28-13-24(14-30-2)10-9-18(32-4)26-16-11-15-17(31-3)12-25(29,19(16)20(15)33-5)27(35-7,23(26)28)22(34-6)21(24)26/h15-23,29H,8-14H2,1-7H3/t15-,16?,17+,18-,19?,20+,21?,22+,23?,24+,25-,26+,27-/m1/s1 |
| InChIKey | WEEGWCFXFNFLEW-FAAGQOMASA-N |
| Mol Weight | 495.7 g/mol |
| Molecular Formula | C27H45NO7 |
| Exact Mass | 495.319603 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 27iDqbDvxZd |
|---|---|
| Name | Dimethyl-delbiterine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H45NO7 |
| InChI | InChI=1S/C27H45NO7/c1-8-28-13-24(14-30-2)10-9-18(32-4)26-16-11-15-17(31-3)12-25(29,19(16)20(15)33-5)27(35-7,23(26)28)22(34-6)21(24)26/h15-23,29H,8-14H2,1-7H3/t15-,16?,17+,18-,19?,20+,21?,22+,23?,24+,25-,26+,27-/m1/s1 |
| InChIKey | WEEGWCFXFNFLEW-FAAGQOMASA-N |
| Molecular Weight | 495.657 g/mol |
| SMILES | O[C@@]12[C@@]3(C4[C@@]5(C6C[C@]([C@](C2)(OC)[H])([C@@](C16)(OC)[H])[H])[C@@](CC[C@@](C5[C@@]3(OC)[H])(COC)CN4CC)(OC)[H])OC |
| SPLASH | splash10-03e9-0000900000-d123d84dc3055fc7fd25 |
| Source of Spectrum | X4-14-88-0 |
| Wiley ID | 1585212 |