| SpectraBase Spectrum ID |
7qL0cv6AMmA |
| Name |
(1R*,4aR*,7R*,9aR*)-10-Benzyl-1-hydroxy-1,3,4,7,8,9a-hexahydro-4a,7-epiminobenzo[7]annulen-9(2H)-one |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
283.157228918 u |
| Formula |
C18H21NO2 |
| InChI |
InChI=1S/C18H21NO2/c20-15-7-4-9-18-10-8-14(11-16(21)17(15)18)19(18)12-13-5-2-1-3-6-13/h1-3,5-6,8,10,14-15,17,20H,4,7,9,11-12H2/t14-,15+,17+,18+/m0/s1 |
| InChIKey |
BFAMRKSFNWVXDL-BURFUSLBSA-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 |
283.371 g/mol |
| Quality |
121 |
| Reported Formula |
C18H21NO2 |
| SMILES |
O[C@@]1(CCC[C@@]23[C@]1(C(C[C@](C=C3)(N2CC1=CC=CC=C1)[H])=O)[H])[H] |
| SPLASH |
splash10-0006-9030000000-b4645b6b28bd2026985c |
| Source of Spectrum |
ACI-57-SM63-3g (DOI: 10.1002/anie.201711439) |
| Thin-Layer Chromatography |
0.62 (EtOAc/hexane, 30%) |
| Wiley ID |
1890709 |
![(1R*,4aR*,7R*,9aR*)-10-Benzyl-1-hydroxy-1,3,4,7,8,9a-hexahydro-4a,7-epiminobenzo[7]annulen-9(2H)-one](/api/spectrum/7qL0cv6AMmA/structure.png?h=300&w=458 "(1R*,4aR*,7R*,9aR*)-10-Benzyl-1-hydroxy-1,3,4,7,8,9a-hexahydro-4a,7-epiminobenzo[7]annulen-9(2H)-one")
