| SpectraBase Compound ID | BY79BLmCf8I |
|---|---|
| InChI | InChI=1S/C8H15NO4/c1-6(7(10)13-4)5-8(2,3)9(11)12/h6H,5H2,1-4H3 |
| InChIKey | FIXGUDASGASFSO-UHFFFAOYSA-N |
| Mol Weight | 189.21 g/mol |
| Molecular Formula | C8H15NO4 |
| Exact Mass | 189.100108 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3TjUAB2sis1 |
|---|---|
| Name | PENTANOIC ACID, 2,4-DIMETHYL-4-NITRO-, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H15NO4 |
| InChI | InChI=1S/C8H15NO4/c1-6(7(10)13-4)5-8(2,3)9(11)12/h6H,5H2,1-4H3 |
| InChIKey | FIXGUDASGASFSO-UHFFFAOYSA-N |
| Molecular Weight | 189.0997 |
| SMILES | C(N(=O)=O)(CC(C(OC)=O)C)(C)C |
| SPLASH | splash10-0536-9100000000-cb10ea108cbe9d660734 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |