| SpectraBase Compound ID | CsxZIF18zAU |
|---|---|
| InChI | InChI=1S/C21H24N2O4/c1-12-14-10-23-8-7-21(16-5-3-4-6-17(16)22-20(21)25)18(23)9-13(14)15(11-27-12)19(24)26-2/h3-6,11-14,18H,7-10H2,1-2H3,(H,22,25)/t12-,13+,14+,18+,21+/m1/s1 |
| InChIKey | JMIAZDVHNCCPDM-PGOHFKEESA-N |
| Mol Weight | 368.43 g/mol |
| Molecular Formula | C21H24N2O4 |
| Exact Mass | 368.173607 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 20pkECBCGS5 |
|---|---|
| Name | Rauniticine-epiallo-oxindole A isomer |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H24N2O4 |
| InChI | InChI=1S/C21H24N2O4/c1-12-14-10-23-8-7-21(16-5-3-4-6-17(16)22-20(21)25)18(23)9-13(14)15(11-27-12)19(24)26-2/h3-6,11-14,18H,7-10H2,1-2H3,(H,22,25)/t12-,13+,14+,18+,21+/m1/s1 |
| InChIKey | JMIAZDVHNCCPDM-PGOHFKEESA-N |
| Molecular Weight | 368.433 g/mol |
| SMILES | N1c2c([C@]3(C1=O)[C@]1(N(C[C@@]4([C@@](C(=CO[C@@]4(C)[H])C(=O)OC)(C1)[H])[H])CC3)[H])cccc2 |
| SPLASH | splash10-00xr-0089000000-d61b5905b9d58ade1987 |
| Source of Spectrum | E1-41-2086-11 |
| Synonyms | (1R,4aS,5aS,6S,10aS)-1-methyl-2'-oxo-4-spiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-1H-indole]carboxylic acid methyl ester methyl (1R,4aS,5aS,6S,10aS)-1-methyl-2'-oxospiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylate methyl (1R,4aS,5aS,6S,10aS)-1-methyl-2'-oxo-spiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-indoline]-4-carboxylate methyl (1R,4aS,5aS,6S,10aS)-1-methyl-2'-oxidanylidene-spiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylate |
| Wiley ID | 1552269 |