| SpectraBase Compound ID | J8Iud7ELmaY |
|---|---|
| InChI | InChI=1S/C8H14O2/c9-7-1-3-8(4-2-7)5-6-10-8/h7,9H,1-6H2/t7-,8+ |
| InChIKey | XMOBSKGLTXGRTN-OCAPTIKFSA-N |
| Mol Weight | 142.2 g/mol |
| Molecular Formula | C8H14O2 |
| Exact Mass | 142.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FCkpeMITEpd |
|---|---|
| Name | Cleroindicin-A |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.099379689 u |
| Formula | C8H14O2 |
| InChI | InChI=1S/C8H14O2/c9-7-1-3-8(4-2-7)5-6-10-8/h7,9H,1-6H2/t7-,8+ |
| InChIKey | XMOBSKGLTXGRTN-OCAPTIKFSA-N |
| Molecular Weight | 142.198 g/mol |
| SMILES | C1O[C@]2(C1)CC[C@](O)(CC2)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.916591 |