![Benzeneacetic acid, 2-[[(3-fluorophenyl)thio]methyl]-alpha-(methoxymethylene)-, methyl ester](/api/spectrum/Eekh0kd7CEq/structure.png?h=300&w=458 "Benzeneacetic acid, 2-[[(3-fluorophenyl)thio]methyl]-alpha-(methoxymethylene)-, methyl ester")
| SpectraBase Compound ID | 3fbk0K0ylTr |
|---|---|
| InChI | InChI=1S/C18H17FO3S/c1-21-11-17(18(20)22-2)16-9-4-3-6-13(16)12-23-15-8-5-7-14(19)10-15/h3-11H,12H2,1-2H3/b17-11+ |
| InChIKey | KSXUFCOBPUMGOF-GZTJUZNOSA-N |
| Mol Weight | 332.39 g/mol |
| Molecular Formula | C18H17FO3S |
| Exact Mass | 332.088244 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | Eekh0kd7CEq |
|---|---|
| Name | Benzeneacetic acid, 2-[[(3-fluorophenyl)thio]methyl]-alpha-(methoxymethylene)-, methyl ester |
| CAS Registry Number | 131775-65-0 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C18H17FO3S |
| InChI | InChI=1S/C18H17FO3S/c1-21-11-17(18(20)22-2)16-9-4-3-6-13(16)12-23-15-8-5-7-14(19)10-15/h3-11H,12H2,1-2H3/b17-11+ |
| InChIKey | KSXUFCOBPUMGOF-GZTJUZNOSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |