| SpectraBase Spectrum ID |
BR6bTuywnxI |
| Name |
(S*,1'S*,4'R*)-(1-Methyl-2-methylene-4-phenethylcyclobutyl)-(6-nitrobenzo[d][1,3]dioxol-5-yl)methanol |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
381.157622840 u |
| Formula |
C22H23NO5 |
| InChI |
InChI=1S/C22H23NO5/c1-14-10-16(9-8-15-6-4-3-5-7-15)22(14,2)21(24)17-11-19-20(28-13-27-19)12-18(17)23(25)26/h3-7,11-12,16,21,24H,1,8-10,13H2,2H3/t16-,21-,22-/m1/s1 |
| InChIKey |
PZTPCGVQWIICFM-NPFVIJTESA-N |
| Instrument Name |
Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201604585 |
| Molecular Weight |
381.428 g/mol |
| Quality |
94 |
| SMILES |
O[C@@]([C@]1([C@@](CC1=C)(CCC1=CC=CC=C1)[H])C)(C1=C(C=C2C(=C1)OCO2)[N+]([O-])=O)[H] |
| SPLASH |
splash10-0005-9700000000-b92c2c8481ff5b2a5e6f |
| Sample Comments |
dr = 99:1:0:0 |
| Source of Spectrum |
QE-23-SM17-12c (DOI: 10.1002/chem.201604585) |
| Thin-Layer Chromatography |
0.39 (hexane/EtOAc, 80:20, UV, KMnO4, PAA) |
| Wiley ID |
1903852 |
![(S*,1'S*,4'R*)-(1-Methyl-2-methylene-4-phenethylcyclobutyl)-(6-nitrobenzo[d][1,3]dioxol-5-yl)methanol](/api/spectrum/BR6bTuywnxI/structure.png?h=300&w=458 "(S*,1'S*,4'R*)-(1-Methyl-2-methylene-4-phenethylcyclobutyl)-(6-nitrobenzo[d][1,3]dioxol-5-yl)methanol")
