| SpectraBase Compound ID | HYoyHbCnrPn |
|---|---|
| InChI | InChI=1S/C7H9NO/c1-5-4-6(8)2-3-7(5)9/h2-4,9H,8H2,1H3 |
| InChIKey | HDGMAACKJSBLMW-UHFFFAOYSA-N |
| Mol Weight | 123.15 g/mol |
| Molecular Formula | C7H9NO |
| Exact Mass | 123.068414 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CXJFAiEsyk6 |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H6D3NO |
| InChI | InChI=1S/C7H9NO/c1-5-4-6(8)2-3-7(5)9/h2-4,9H,8H2,1H3 |
| InChIKey | HDGMAACKJSBLMW-UHFFFAOYSA-N |
| Molecular Weight | 123.0682 |
| SMILES | Nc1cc(c(O)cc1)C |
| SPLASH | splash10-004i-8900000000-9b95596b322c5d5145eb |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |