| SpectraBase Compound ID | IRcA8KRMY4r |
|---|---|
| InChI | InChI=1S/C9H10O4/c1-2-6(11)9-7(12)3-5(10)4-8(9)13/h3-4,10,12-13H,2H2,1H3 |
| InChIKey | PTHLEKANMPKYDB-UHFFFAOYSA-N |
| Mol Weight | 182.17 g/mol |
| Molecular Formula | C9H10O4 |
| Exact Mass | 182.057909 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1gbuh3mfM3I |
|---|---|
| Name | 1-PROPANONE, 1-(2,4,6-TRIHYDROXYPHENYL)- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H10O4 |
| InChI | InChI=1S/C9H10O4/c1-2-6(11)9-7(12)3-5(10)4-8(9)13/h3-4,10,12-13H,2H2,1H3 |
| InChIKey | PTHLEKANMPKYDB-UHFFFAOYSA-N |
| Molecular Weight | 182.0576 |
| SMILES | Oc1cc(c(c(O)c1)C(CC)=O)O |
| SPLASH | splash10-0udi-5900000000-c52cf32fcb9652d85eab |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |