SpectraBase Compound ID | LQHGInbXbP4 |
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InChI | InChI=1S/C11H11BrN2S.C2H2O4/c12-9-3-1-8(2-4-9)10-7-14-5-6-15-11(14)13-10;3-1(4)2(5)6/h1-4,10H,5-7H2;(H,3,4)(H,5,6)/t10-;/m0./s1 |
InChIKey | ZULBIBHDIQCNIS-PPHPATTJSA-N |
Mol Weight | 373.22 g/mol |
Molecular Formula | C13H13BrN2O4S |
Exact Mass | 371.977941 g/mol |
SpectraBase Spectrum ID | 4HcCMx1mFJA |
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Name | (+)-p-Bromotetramisole oxalate |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 190055 |
CAS Registry Number | 71461-24-0 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C13H13BrN2O4S |
InChI | InChI=1S/C11H11BrN2S.C2H2O4/c12-9-3-1-8(2-4-9)10-7-14-5-6-15-11(14)13-10;3-1(4)2(5)6/h1-4,10H,5-7H2;(H,3,4)(H,5,6)/t10-;/m0./s1 |
InChIKey | ZULBIBHDIQCNIS-PPHPATTJSA-N |
Observed nucleus | 13C |
Purity | 99% |
Solvent | DMSO-d6 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_13CNMR_002536 |