| SpectraBase Spectrum ID |
1WhK417mBnR |
| Name |
1-Isobutyl-2-pentynyl 2,6-difluorobenzoate |
| Alternate Name(s) |
2,6-Difluorobenzoic acid, 2-methyloct-5-yn-4-yl ester
2,6-Difluorobenzoic acid 2-methyloct-5-yn-4-yl ester
2-Methyloct-5-yn-4-yl 2,6-difluorobenzoate
1-isobutylpent-2-ynyl 2,6-difluorobenzoate
2-Methyloct-5-yn-4-yl 2,6-bis(fluoranyl)benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18F2O2 |
| InChI |
InChI=1S/C16H18F2O2/c1-4-5-7-12(10-11(2)3)20-16(19)15-13(17)8-6-9-14(15)18/h6,8-9,11-12H,4,10H2,1-3H3 |
| InChIKey |
XMSIREIWTIXZDM-UHFFFAOYSA-N |
| Molecular Weight |
280.315 g/mol |
| SMILES |
C(=O)(OC(C#CCC)CC(C)C)c1c(F)cccc1F |
| SPLASH |
splash10-0006-5900000000-9f9c39c4b4b2d0a70d64 |
| Source of Spectrum |
NP-8-9074-0 |
| Wiley ID |
1107708 |
