| SpectraBase Spectrum ID |
HwhOnIv4Kbf |
| Name |
[(3R,4S,6R)-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] 4-(4-nitrophenyl)piperazine-1-carboxylate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H35N3O6 |
| InChI |
InChI=1S/C26H35N3O6/c1-18(2)4-9-23-25(3,35-23)22-16-21(10-11-26(22)17-33-26)34-24(30)28-14-12-27(13-15-28)19-5-7-20(8-6-19)29(31)32/h4-8,21-23H,9-17H2,1-3H3/t21-,22-,23-,25-,26+/m1/s1 |
| InChIKey |
ZNAXQPORRTZVMK-XWIKPDKDSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Molecular Weight |
485.581 g/mol |
| Optical Rotation |
[a]D23 = -14.5 (c = 0.38, CH2Cl2) |
| Reported Formula |
C26H35N3O6 |
| SMILES |
[C@@]1([C@]([C@@]2([C@]3(OC3)CC[C@](C2)(OC(N2CCN(CC2)c2ccc(cc2)[N+](=O)[O-])=O)[H])[H])(C)O1)(CC=C(C)C)[H] |
| SPLASH |
splash10-00xs-0390200000-e62fa55fe08df4659981 |
| Source of Spectrum |
US8299067B2 |
| Thin-Layer Chromatography |
Rf = 0.53 (silica gel, hexanes/EtOAc, 1:2) |
| Wiley ID |
1846868 |
![[(3R,4S,6R)-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] 4-(4-nitrophenyl)piperazine-1-carboxylate](/api/spectrum/HwhOnIv4Kbf/structure.png?h=300&w=458 "[(3R,4S,6R)-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] 4-(4-nitrophenyl)piperazine-1-carboxylate")
