| SpectraBase Compound ID | KOA6aFqAffU |
|---|---|
| InChI | InChI=1S/C10H20O2.H2O/c1-9(2,11)8-4-6-10(3,12)7-5-8;/h8,11-12H,4-7H2,1-3H3;1H2/t8-,10+; |
| InChIKey | JGKJMBOJWVAMIJ-OFAZAQPOSA-N |
| Mol Weight | 190.283 g/mol |
| Molecular Formula | C10H22O3 |
| Exact Mass | 190.156895 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1W8fweQEoUv |
|---|---|
| Name | Terpin hydrate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.156894565 u |
| Formula | C10H22O3 |
| InChI | InChI=1S/C10H20O2.H2O/c1-9(2,11)8-4-6-10(3,12)7-5-8;/h8,11-12H,4-7H2,1-3H3;1H2/t8-,10+; |
| InChIKey | JGKJMBOJWVAMIJ-OFAZAQPOSA-N |
| Molecular Weight | 190.283 g/mol |
| SMILES | OC([C@]1(CC[C@](CC1)(O)C)[H])(C)C.O |
| Spectrum/Structure Validation Score (Raman) | 0.914794 |