1,4-Cyclohexanedicarboxylic acid
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01108105
Dataset description:
This MassBank record with Accession MSBNK-Eawag-EQ01108105 contains the MS2 mass spectrum of 1,4-Cyclohexanedicarboxylic acid with the InChIkey PXGZQGDTEZPERC-UHFFFAOYSA-N.
Source: 1,4-Cyclohexanedicarboxylic acid
Chemical Info
| InChI | InChI=1S/C8H12O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12) |
|---|---|
| SMILES | OC(=O)C1CCC(CC1)C(O)=O |
| InChI Key | PXGZQGDTEZPERC-UHFFFAOYSA-N |
| Molecular Formula | C8H12O4 |
| Exact Mass | 172.074 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | February 9, 2025 |
| Metadata last updated | February 9, 2025 |
| Created | February 9, 2025 |
| Format | HTML |
| License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 94610146-c5b8-4381-9ec8-5159e238ec9c |
| Package id | msbnk-eawag-eq01108105 |
| Resource type | HTML |
| State | active |