| SpectraBase Compound ID | LY1i0t3WW6z |
|---|---|
| InChI | InChI=1S/C9H13NO3/c1-4-12-9(11)8-5-7(6(2)3)10-13-8/h5-6H,4H2,1-3H3 |
| InChIKey | SZORJEQCHPOLBC-UHFFFAOYSA-N |
| Mol Weight | 183.21 g/mol |
| Molecular Formula | C9H13NO3 |
| Exact Mass | 183.089543 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EqNPsAVTH0S |
|---|---|
| Name | 3-Isopropylisoxazole-5-carboxylic acid, ethyl ester |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H13NO3 |
| InChI | InChI=1S/C9H13NO3/c1-4-12-9(11)8-5-7(6(2)3)10-13-8/h5-6H,4H2,1-3H3 |
| InChIKey | SZORJEQCHPOLBC-UHFFFAOYSA-N |
| Molecular Weight | 183.0892 |
| SMILES | c1(C(OCC)=O)onc(C(C)C)c1 |
| SPLASH | splash10-016u-9100000000-ff96592ef2c8e0aec26b |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |