SpectraBase Compound ID | JDW8DpQGILC |
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InChI | InChI=1S/C11H13ClO3/c1-8-7-9(12)4-5-10(8)15-6-2-3-11(13)14/h4-5,7H,2-3,6H2,1H3,(H,13,14) |
InChIKey | LLWADFLAOKUBDR-UHFFFAOYSA-N |
Mol Weight | 228.67 g/mol |
Molecular Formula | C11H13ClO3 |
Exact Mass | 228.055322 g/mol |
SpectraBase Spectrum ID | 7B80HiDnMX6 |
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Name | 4-(4-Chloro-o-tolyloxy)butyric acid |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 232998 |
CAS Registry Number | 94-81-5 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C11H13ClO3 |
InChI | InChI=1S/C11H13ClO3/c1-8-7-9(12)4-5-10(8)15-6-2-3-11(13)14/h4-5,7H,2-3,6H2,1H3,(H,13,14) |
InChIKey | LLWADFLAOKUBDR-UHFFFAOYSA-N |
Observed nucleus | 1H |
Purity | 98% |
Solvent | CDCl3 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_1HNMR_003578 |