![Bicyclo[4.1.0]heptane, 3-methyl-](/api/spectrum/6fbmM8VKX4F/structure.png?h=300&w=458 "Bicyclo[4.1.0]heptane, 3-methyl-")
| SpectraBase Compound ID | C9tYAV3Slxt |
|---|---|
| InChI | InChI=1S/C8H14/c1-6-2-3-7-5-8(7)4-6/h6-8H,2-5H2,1H3 |
| InChIKey | QYCGHFOTMYKMIY-UHFFFAOYSA-N |
| Mol Weight | 110.2 g/mol |
| Molecular Formula | C8H14 |
| Exact Mass | 110.10955 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6fbmM8VKX4F |
|---|---|
| Name | Bicyclo[4.1.0]heptane, 3-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 110.109550451 u |
| Formula | C8H14 |
| InChI | InChI=1S/C8H14/c1-6-2-3-7-5-8(7)4-6/h6-8H,2-5H2,1H3 |
| InChIKey | QYCGHFOTMYKMIY-UHFFFAOYSA-N |
| Molecular Weight | 110.200 g/mol |
| SMILES | CC1CC2C(CC1)C2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.842227 |