| SpectraBase Compound ID | 4rl4uLUlqG8 |
|---|---|
| InChI | InChI=1S/C10H16O7/c1-6(8(12)16-3)10(14,9(13)17-4)5-7(11)15-2/h6,14H,5H2,1-4H3 |
| InChIKey | PGBQGAKMUFDUSD-UHFFFAOYSA-N |
| Mol Weight | 248.23 g/mol |
| Molecular Formula | C10H16O7 |
| Exact Mass | 248.089603 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1fhrrcl6bNT |
|---|---|
| Name | CITRONENIC ACID, METHYL-, TRIMETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C10H16O7 |
| InChI | InChI=1S/C10H16O7/c1-6(8(12)16-3)10(14,9(13)17-4)5-7(11)15-2/h6,14H,5H2,1-4H3 |
| InChIKey | PGBQGAKMUFDUSD-UHFFFAOYSA-N |
| Molecular Weight | 248.0891 |
| SMILES | OC(C(C(OC)=O)C)(CC(OC)=O)C(=O)OC |
| SPLASH | splash10-0a4i-9400000000-268f5cc164b9147b2549 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |