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SpectraBase Compound ID | GTPW6ohzp70 |
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InChI | InChI=1S/C10H14O4/c1-2-3-8-14-10(13)7-5-4-6-9(11)12/h4-7H,2-3,8H2,1H3,(H,11,12)/b6-4+,7-5- |
InChIKey | LPARONCWTGERSI-GUBXDBFYSA-N |
Mol Weight | 198.22 g/mol |
Molecular Formula | C10H14O4 |
Exact Mass | 198.089209 g/mol |
SpectraBase Spectrum ID | 3SnPphY4nrP |
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Name | 2,4-Hexadienedioic acid, monobutyl ester, (E,E)- |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 198.089208927 u |
Formula | C10H14O4 |
InChI | InChI=1S/C10H14O4/c1-2-3-8-14-10(13)7-5-4-6-9(11)12/h4-7H,2-3,8H2,1H3,(H,11,12)/b6-4+,7-5- |
InChIKey | LPARONCWTGERSI-GUBXDBFYSA-N |
Molecular Weight | 198.218 g/mol |
SMILES | C(\C=C\C=C/C(=O)OCCCC)(=O)O |