| SpectraBase Spectrum ID |
RP0xWSlcm3 |
| Name |
O-BOC-3-epi-E-geissoschizine trans-N(b)-oxide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H32N2O6 |
| InChI |
InChI=1S/C26H32N2O6/c1-6-16-14-28(31)12-11-18-17-9-7-8-10-21(17)27-23(18)22(28)13-19(16)20(24(29)32-5)15-33-25(30)34-26(2,3)4/h6-10,15,19,22,27H,11-14H2,1-5H3/b16-6+,20-15-/t19-,22+,28?/m0/s1 |
| InChIKey |
AOOBJDHQFKTYDY-JUQLPURISA-N |
| Molecular Weight |
468.550 g/mol |
| SMILES |
[nH]1c2ccccc2c2CC[N+]3([C@@](c12)(C[C@@](\C(C3)=C/C)(\C(=C\OC(OC(C)(C)C)=O)C(=O)OC)[H])[H])[O-] |
| SPLASH |
splash10-014i-0900000000-b1502bdf82d03e7cd334 |
| Source of Spectrum |
F-52-6807-7 |
| Synonyms |
methyl (2Z)-2-[(2S,3Z,12bR)-3-ethylidene-5-oxido-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-[(tert-butoxycarbonyl)oxy]-2-propenoate |
| Wiley ID |
796518 |
