| SpectraBase Spectrum ID |
1VL4k44yf0W |
| Name |
(1R*,4aS*,7S*,9aR*)-1-Hydroxy-10-tosyl-1,3,4,7,8,9a-hexahydro-4a,7-epiminobenzo[7]annulen-9(2H)-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
347.119129330 u |
| Formula |
C18H21NO4S |
| InChI |
InChI=1S/C18H21NO4S/c1-12-4-6-14(7-5-12)24(22,23)19-13-8-10-18(19)9-2-3-15(20)17(18)16(21)11-13/h4-8,10,13,15,17,20H,2-3,9,11H2,1H3/t13-,15+,17+,18-/m0/s1 |
| InChIKey |
HIKZLWFWUSPTNJ-NZPGVSJUSA-N |
| Instrument Name |
Finnigan MAT 95 or API QSTAR PULSAR iLC/MS/TOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201711439 |
| Molecular Weight |
347.429 g/mol |
| Quality |
132 |
| Reported Formula |
C18H21NO4S |
| SMILES |
O[C@@]1(CCC[C@]23[C@]1(C(C[C@](C=C3)(N2S(C1=CC=C(C=C1)C)(=O)=O)[H])=O)[H])[H] |
| SPLASH |
splash10-0aba-0901000000-a55a13ea522b8a31d968 |
| Source of Spectrum |
ACI-57-SM57-4c (DOI: 10.1002/anie.201711439) |
| Thin-Layer Chromatography |
0.27 (EtOAc/hexane, 5%) |
| Wiley ID |
1890716 |
![(1R*,4aS*,7S*,9aR*)-1-Hydroxy-10-tosyl-1,3,4,7,8,9a-hexahydro-4a,7-epiminobenzo[7]annulen-9(2H)-one](/api/spectrum/1VL4k44yf0W/structure.png?h=300&w=458 "(1R*,4aS*,7S*,9aR*)-1-Hydroxy-10-tosyl-1,3,4,7,8,9a-hexahydro-4a,7-epiminobenzo[7]annulen-9(2H)-one")
