SpectraBase Compound ID | 6GSuf2ac2ID |
---|---|
InChI | InChI=1S/C10H16O/c1-7-4-3-5-9-8(2)6-11-10(7)9/h8-9H,3-6H2,1-2H3 |
InChIKey | YWSBRMYYZMGIEY-UHFFFAOYSA-N |
Mol Weight | 152.24 g/mol |
Molecular Formula | C10H16O |
Exact Mass | 152.120115 g/mol |
SpectraBase Spectrum ID | BGjUdwwBMKF |
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Name | 3,7-Dimethyl-2,3,3A,4,5,6-hexahydro-1-benzofuran # |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 152.120115134 u |
Formula | C10H16O |
InChI | InChI=1S/C10H16O/c1-7-4-3-5-9-8(2)6-11-10(7)9/h8-9H,3-6H2,1-2H3 |
InChIKey | YWSBRMYYZMGIEY-UHFFFAOYSA-N |
Molecular Weight | 152.237 g/mol |
SMILES | C1CC(=C2C(C1)C(C)CO2)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937712 |