| SpectraBase Spectrum ID |
LwouRUqOBjy |
| Name |
1,3-butanedione, 1-(1,3-benzodioxol-5-yl)-4,4,4-trifluoro-2-tricyclo[3.3.1.1~3,7~]dec-1-yl- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
394.139193641 u |
| Formula |
C21H21F3O4 |
| InChI |
InChI=1S/C21H21F3O4/c22-21(23,24)19(26)17(18(25)14-1-2-15-16(6-14)28-10-27-15)20-7-11-3-12(8-20)5-13(4-11)9-20/h1-2,6,11-13,17H,3-5,7-10H2/t11-,12+,13-,17?,20- |
| InChIKey |
FFLMQMHVDRODBH-COTOFCMUSA-N |
| Molecular Weight |
394.390 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_1756 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13268203 |
![1,3-butanedione, 1-(1,3-benzodioxol-5-yl)-4,4,4-trifluoro-2-tricyclo[3.3.1.1~3,7~]dec-1-yl-](/api/spectrum/LwouRUqOBjy/structure.png?h=300&w=458 "1,3-butanedione, 1-(1,3-benzodioxol-5-yl)-4,4,4-trifluoro-2-tricyclo[3.3.1.1~3,7~]dec-1-yl-")
