| SpectraBase Compound ID | 7wfdiilPucF |
|---|---|
| InChI | InChI=1S/C7H3Cl5O/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h1H3 |
| InChIKey | BBABSCYTNHOKOG-UHFFFAOYSA-N |
| Mol Weight | 280.4 g/mol |
| Molecular Formula | C7H3Cl5O |
| Exact Mass | 277.862653 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DiNCzsPg99P |
|---|---|
| Name | Pentachloroanisol |
| CAS Registry Number | 1825-21-4 |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C7H3Cl5O |
| InChI | InChI=1S/C7H3Cl5O/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h1H3 |
| InChIKey | BBABSCYTNHOKOG-UHFFFAOYSA-N |
| Instrument Name | SF = 080 MHz |
| Literature Reference | J. Org. Chem. 46, 4800 (1981). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |