SpectraBase Compound ID | CUxiLoBO4dZ |
---|---|
InChI | InChI=1S/C7H10/c1-7-4-2-3-5(7)6(4)7/h4-6H,2-3H2,1H3 |
InChIKey | CNLZXRHZYUPLSK-UHFFFAOYSA-N |
Mol Weight | 94.16 g/mol |
Molecular Formula | C7H10 |
Exact Mass | 94.07825 g/mol |
SpectraBase Spectrum ID | 76LLomhQVO3 |
---|---|
Name | Tricyclo[3.1.0.02,6]hexane, 1-methyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 94.078250322 u |
Formula | C7H10 |
InChI | InChI=1S/C7H10/c1-7-4-2-3-5(7)6(4)7/h4-6H,2-3H2,1H3 |
InChIKey | CNLZXRHZYUPLSK-UHFFFAOYSA-N |
Molecular Weight | 94.157 g/mol |
SMILES | C12(C3C2CCC13)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.984646 |