| SpectraBase Compound ID | IVYvWnNxNPf |
|---|---|
| InChI | InChI=1S/C9H17NO3/c1-6(2)7(9(10)12)4-5-8(11)13-3/h6-7H,4-5H2,1-3H3,(H2,10,12) |
| InChIKey | DYOAYKGSXWZNBH-UHFFFAOYSA-N |
| Mol Weight | 187.24 g/mol |
| Molecular Formula | C9H17NO3 |
| Exact Mass | 187.120843 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | V8LIJXmhW0 |
|---|---|
| Name | 4-CARBAMOYL-5-METHYLHEXANOIC ACID, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H17NO3 |
| InChI | InChI=1S/C9H17NO3/c1-6(2)7(9(10)12)4-5-8(11)13-3/h6-7H,4-5H2,1-3H3,(H2,10,12) |
| InChIKey | DYOAYKGSXWZNBH-UHFFFAOYSA-N |
| Molecular Weight | 187.1204 |
| SMILES | NC(=O)C(C(C)C)CCC(=O)OC |
| SPLASH | splash10-00dl-9400000000-81b923ce42ec03bd63f5 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |