| SpectraBase Spectrum ID |
HJY1MAkB27d |
| Name |
(1S,3R,4aR)-6,7-Dimethoxy-1-(4-nitro-phenyl)-3-phenyl-4,4a,9,10-tetrahydro-3H-2-oxa-10a-aza-phenanthrene |
| Alternate Name(s) |
(2R*,4S*,11bR*)-9,10-Dimethoxy-2-phenyl-4-(p-nitrophenyl)-1,6,7,11b-tetrahydro-2H,4H-1,3-oxazino[4,3-a]isoquinoline |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H26N2O5 |
| InChI |
InChI=1S/C26H26N2O5/c1-31-24-14-19-12-13-27-22(21(19)15-25(24)32-2)16-23(17-6-4-3-5-7-17)33-26(27)18-8-10-20(11-9-18)28(29)30/h3-11,14-15,22-23,26H,12-13,16H2,1-2H3/t22-,23-,26+/m1/s1 |
| InChIKey |
MWNNSIRPOCZUED-PLXFJCCSSA-N |
| Molecular Weight |
446.503 g/mol |
| SMILES |
[C@]12(N(CCc3c2cc(c(c3)OC)OC)[C@@](O[C@](C1)(c1ccccc1)[H])(c1ccc(N(=O)=O)cc1)[H])[H] |
| SPLASH |
splash10-03di-0009000000-f9b604ad46a76d9eacd8 |
| Source of Spectrum |
F-59-1957-11 |
| Wiley ID |
1677412 |
