| SpectraBase Compound ID | 1d7oOI6XCBG |
|---|---|
| InChI | InChI=1S/C8H12O4/c9-6(10)8(7(11)12)4-2-1-3-5-8/h1-5H2,(H,9,10)(H,11,12) |
| InChIKey | QYQADNCHXSEGJT-UHFFFAOYSA-N |
| Mol Weight | 172.18 g/mol |
| Molecular Formula | C8H12O4 |
| Exact Mass | 172.073559 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1baPYOS8alm |
|---|---|
| Name | trans-Dicarboxycyclohexane |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H12O4 |
| InChI | InChI=1S/C8H12O4/c9-6(10)8(7(11)12)4-2-1-3-5-8/h1-5H2,(H,9,10)(H,11,12) |
| InChIKey | QYQADNCHXSEGJT-UHFFFAOYSA-N |
| Molecular Weight | 172.180 g/mol |
| SMILES | OC(C1(C(=O)O)CCCCC1)=O |
| SPLASH | splash10-001i-9100000000-6ee6ab35223c6afc1cf4 |
| Source of Spectrum | JX-2015-6-5305 |
| Synonyms | Cyclohexane-1,1-dicarboxylic acid |
| Wiley ID | 1729082 |