| SpectraBase Spectrum ID |
9N4STKlCbla |
| Name |
(1R,6R,8S)-8-(5-Bromothiophen-2-yl)-2-methyl-6-trifluoromethyl-5,7-dioxa-2-azabicyclo[4.2.0]octane |
| Appearance |
Pale brown oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
356.964597259 u |
| Formula |
C11H11BrF3NO2S |
| InChI |
InChI=1S/C11H11BrF3NO2S/c1-16-4-5-17-10(11(13,14)15)9(16)8(18-10)6-2-3-7(12)19-6/h2-3,8-9H,4-5H2,1H3/t8-,9-,10-/m1/s1 |
| InChIKey |
KWLSUELWPNJEBI-OPRDCNLKSA-N |
| Instrument Name |
Shimadzu GCMS-QP5050A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201800659 |
| Molecular Weight |
358.173 g/mol |
| Quality |
154 |
| SMILES |
[C@@]12([C@@](OCCN2C)(O[C@@]1(C1=CC=C(Br)S1)[H])C(F)(F)F)[H] |
| SPLASH |
splash10-066s-6924000000-140f0c58b5fbfa2bec83 |
| Source of Spectrum |
K1-2018-4209-5b (DOI: 10.1002/ejoc.201800659) |
| Wiley ID |
1894218 |
![(1R,6R,8S)-8-(5-Bromothiophen-2-yl)-2-methyl-6-trifluoromethyl-5,7-dioxa-2-azabicyclo[4.2.0]octane](/api/spectrum/9N4STKlCbla/structure.png?h=300&w=458 "(1R,6R,8S)-8-(5-Bromothiophen-2-yl)-2-methyl-6-trifluoromethyl-5,7-dioxa-2-azabicyclo[4.2.0]octane")
