SpectraBase Compound ID | 7v780K0i1QP |
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InChI | InChI=1S/C11H9N3O2/c15-10(8-4-2-1-3-5-8)13-9-6-7-12-11(16)14-9/h1-7H,(H2,12,13,14,15,16) |
InChIKey | XBDUZBHKKUFFRH-UHFFFAOYSA-N |
Mol Weight | 215.21 g/mol |
Molecular Formula | C11H9N3O2 |
Exact Mass | 215.069477 g/mol |
SpectraBase Spectrum ID | 2tpGhtGkBN5 |
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Name | N4-Benzoylcytosine |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 436798 |
CAS Registry Number | 26661-13-2 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C11H9N3O2 |
InChI | InChI=1S/C11H9N3O2/c15-10(8-4-2-1-3-5-8)13-9-6-7-12-11(16)14-9/h1-7H,(H2,12,13,14,15,16) |
InChIKey | XBDUZBHKKUFFRH-UHFFFAOYSA-N |
Observed nucleus | 13C |
Purity | 98% |
Solvent | D2O & NaOD |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_13CNMR_009573 |