SpectraBase Compound ID | 4NWjFGXfdN2 |
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InChI | InChI=1S/C8H7NO4/c10-8(11)5-6-1-3-7(4-2-6)9(12)13/h1-4H,5H2,(H,10,11) |
InChIKey | YBADLXQNJCMBKR-UHFFFAOYSA-N |
Mol Weight | 181.15 g/mol |
Molecular Formula | C8H7NO4 |
Exact Mass | 181.037508 g/mol |
SpectraBase Spectrum ID | Hg80dmGsXRb |
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Name | 4-Nitrophenylacetic acid |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | N20204 |
CAS Registry Number | 104-03-0 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H7NO4 |
InChI | InChI=1S/C8H7NO4/c10-8(11)5-6-1-3-7(4-2-6)9(12)13/h1-4H,5H2,(H,10,11) |
InChIKey | YBADLXQNJCMBKR-UHFFFAOYSA-N |
Observed nucleus | 13C |
Purity | 99% |
Solvent | DMSO-d6 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_13CNMR_012458 |