| SpectraBase Spectrum ID |
AAaGCbbQ9v2 |
| Name |
(2aS*,5aS*,6R*,10bR*)-6-(4-Bromophenyl)-5,5a,6,10b-tetrahydro-3H-cyclobuta[1,2]naphtho[2,3-c]furan-2-carbonitrile |
| Appearance |
Pale yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
377.041527138 u |
| Formula |
C21H16BrNO |
| InChI |
InChI=1S/C21H16BrNO/c22-15-7-5-13(6-8-15)20-17-4-2-1-3-16(17)18-9-14(10-23)21(18)12-24-11-19(20)21/h1-9,18-20H,11-12H2/t18-,19+,20-,21-/m1/s1 |
| InChIKey |
WENYYGXCSZNGFG-PLACYPQZSA-N |
| Instrument Name |
JEOL JMS-700 |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/ejoc.202201051 |
| Molecular Weight |
378.269 g/mol |
| Quality |
410 |
| Reported Formula |
C21H16BrNO |
| SMILES |
C1=CC2=C(C=C1)[C@@]1([C@]3([C@]([C@@]2(C2=CC=C(C=C2)Br)[H])(COC3)[H])C(=C1)C#N)[H] |
| SPLASH |
splash10-00or-0579000000-22a898653b70c89399b8 |
| Source of Spectrum |
K1-2022-12-trans-7ad (DOI: 10.1002/ejoc.202201051) |
| Wiley ID |
1898997 |
![(2aS*,5aS*,6R*,10bR*)-6-(4-Bromophenyl)-5,5a,6,10b-tetrahydro-3H-cyclobuta[1,2]naphtho[2,3-c]furan-2-carbonitrile](/api/spectrum/AAaGCbbQ9v2/structure.png?h=300&w=458 "(2aS*,5aS*,6R*,10bR*)-6-(4-Bromophenyl)-5,5a,6,10b-tetrahydro-3H-cyclobuta[1,2]naphtho[2,3-c]furan-2-carbonitrile")
