| SpectraBase Compound ID | BGTq2J4p2X9 |
|---|---|
| InChI | InChI=1S/C10H9NO3/c1-8(12)2-3-9-4-6-10(7-5-9)11(13)14/h2-7H,1H3/b3-2+ |
| InChIKey | KMCRQJMZUHNLKJ-NSCUHMNNSA-N |
| Mol Weight | 191.19 g/mol |
| Molecular Formula | C10H9NO3 |
| Exact Mass | 191.058243 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CIREXtlIGnV |
|---|---|
| Name | ACENOCOUMAROL-ARTIFACT 1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C10H9NO3 |
| InChI | InChI=1S/C10H9NO3/c1-8(12)2-3-9-4-6-10(7-5-9)11(13)14/h2-7H,1H3/b3-2+ |
| InChIKey | KMCRQJMZUHNLKJ-NSCUHMNNSA-N |
| Instrument Name | GC |
| Molecular Weight | 191.186 g/mol |
| SMILES | C(\C=C\c1ccc(N(=O)=O)cc1)(C)=O |
| SPLASH | splash10-0fbc-8900000000-b7f14b3bd7a76aa87f5b |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |