SpectraBase Compound ID | 4uMXWHPMJYy |
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InChI | InChI=1S/C9H9NO3/c1-6(11)10-8-4-2-7(3-5-8)9(12)13/h2-5H,1H3,(H,10,11)(H,12,13) |
InChIKey | QCXJEYYXVJIFCE-UHFFFAOYSA-N |
Mol Weight | 179.17 g/mol |
Molecular Formula | C9H9NO3 |
Exact Mass | 179.058243 g/mol |
SpectraBase Spectrum ID | JW8p2DlVh1b |
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Name | 4-Acetamidobenzoic acid |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 133337 |
CAS Registry Number | 556-08-1 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C9H9NO3 |
InChI | InChI=1S/C9H9NO3/c1-6(11)10-8-4-2-7(3-5-8)9(12)13/h2-5H,1H3,(H,10,11)(H,12,13) |
InChIKey | QCXJEYYXVJIFCE-UHFFFAOYSA-N |
Observed nucleus | 13C |
Purity | 98% |
Solvent | DMSO-d6 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Synonyms | N-Acetyl-PABA |
Wiley ID | SIAL_13CNMR_000972 |