| SpectraBase Compound ID | LdT9GQEg3MT |
|---|---|
| InChI | InChI=1S/C7H12O2/c8-5-6-3-1-2-4-7(6)9/h1-2,6-9H,3-5H2/t6-,7-/m1/s1 |
| InChIKey | LDMQJPMKGCKSPM-RNFRBKRXSA-N |
| Mol Weight | 128.17 g/mol |
| Molecular Formula | C7H12O2 |
| Exact Mass | 128.08373 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 34pBtxcukSa |
|---|---|
| Name | (1R,6R)-6-(Hydroxymethyl)-3-cyclohexen-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 128.083729624 u |
| Formula | C7H12O2 |
| InChI | InChI=1S/C7H12O2/c8-5-6-3-1-2-4-7(6)9/h1-2,6-9H,3-5H2/t6-,7-/m1/s1 |
| InChIKey | LDMQJPMKGCKSPM-RNFRBKRXSA-N |
| SMILES | [C@@]1([C@](O)(CC=CC1)[H])(CO)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.908928 |