SpectraBase Compound ID | I4B55rPsR8P |
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InChI | InChI=1S/C8H7BrO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3 |
InChIKey | CZNGTXVOZOWWKM-UHFFFAOYSA-N |
Mol Weight | 215.05 g/mol |
Molecular Formula | C8H7BrO2 |
Exact Mass | 213.962942 g/mol |
SpectraBase Spectrum ID | Iq5rNSaZciZ |
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Name | Methyl 4-bromobenzoate |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 407593 |
CAS Registry Number | 619-42-1 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H7BrO2 |
InChI | InChI=1S/C8H7BrO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3 |
InChIKey | CZNGTXVOZOWWKM-UHFFFAOYSA-N |
Observed nucleus | 1H |
Purity | 99% |
Solvent | CDCl3 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_1HNMR_008882 |