| SpectraBase Spectrum ID |
3FmjNdHlnU |
| Name |
(1R,6R,8S)-8-(5-Bromofur-2-yl)-2-methyl-6-trifluoromethyl-5,7-dioxa-2-azabicyclo[4.2.0]octane |
| Appearance |
Brown oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.987440704 u |
| Formula |
C11H11BrF3NO3 |
| InChI |
InChI=1S/C11H11BrF3NO3/c1-16-4-5-17-10(11(13,14)15)9(16)8(19-10)6-2-3-7(12)18-6/h2-3,8-9H,4-5H2,1H3/t8-,9-,10-/m1/s1 |
| InChIKey |
QQCWIUNUELGXNN-OPRDCNLKSA-N |
| Instrument Name |
Shimadzu GCMS-QP5050A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201800659 |
| Molecular Weight |
342.112 g/mol |
| Quality |
217 |
| SMILES |
[C@@]12([C@@](OCCN2C)(O[C@@]1(C=1OC(=CC1)Br)[H])C(F)(F)F)[H] |
| SPLASH |
splash10-0005-9200000000-5584247ab123afd9413d |
| Source of Spectrum |
K1-2018-4209-5d (DOI: 10.1002/ejoc.201800659) |
| Wiley ID |
1894220 |
![(1R,6R,8S)-8-(5-Bromofur-2-yl)-2-methyl-6-trifluoromethyl-5,7-dioxa-2-azabicyclo[4.2.0]octane](/api/spectrum/3FmjNdHlnU/structure.png?h=300&w=458 "(1R,6R,8S)-8-(5-Bromofur-2-yl)-2-methyl-6-trifluoromethyl-5,7-dioxa-2-azabicyclo[4.2.0]octane")
