| SpectraBase Spectrum ID |
CfTS0DvB6Xm |
| Name |
3-methyl-4-[(1,1,2,2,3,3,3-heptafluoropropyl)selanyl]benzoic acid |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
383.949948604 u |
| Formula |
C11H7F7O2Se |
| InChI |
InChI=1S/C11H7F7O2Se/c1-5-4-6(8(19)20)2-3-7(5)21-11(17,18)9(12,13)10(14,15)16/h2-4H,1H3,(H,19,20) |
| InChIKey |
QXCICFVSHKXWKA-UHFFFAOYSA-N |
| Instrument Name |
Agilent 7200 GC/Q-TOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201806165 |
| Molecular Weight |
383.136 g/mol |
| Quality |
731 |
| Reported Formula |
C11H7F7O2Se |
| SMILES |
OC(C=1C=C(C(=CC1)[Se]C(C(C(F)(F)F)(F)F)(F)F)C)=O |
| SPLASH |
splash10-001i-0519000000-3a5f19981fe8e0dc1382 |
| Source of Spectrum |
ACI-57-SM104-4l (DOI: 10.1002/anie.201806165) |
| Wiley ID |
1893315 |
![3-methyl-4-[(1,1,2,2,3,3,3-heptafluoropropyl)selanyl]benzoic acid](/api/spectrum/CfTS0DvB6Xm/structure.png?h=300&w=458 "3-methyl-4-[(1,1,2,2,3,3,3-heptafluoropropyl)selanyl]benzoic acid")
