SpectraBase Compound ID | AzmHKon8aTJ |
---|---|
InChI | InChI=1S/C10H14O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H2 |
InChIKey | KMEDIOVHRDQREA-UHFFFAOYSA-N |
Mol Weight | 150.22 g/mol |
Molecular Formula | C10H14O |
Exact Mass | 150.104465 g/mol |
SpectraBase Spectrum ID | Kh5Oa8ywtWL |
---|---|
Name | 3,4,5,6,7,8-Hexahydro-2(1H)-naphthalenone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 150.104465070 u |
Formula | C10H14O |
InChI | InChI=1S/C10H14O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H2 |
InChIKey | KMEDIOVHRDQREA-UHFFFAOYSA-N |
Molecular Weight | 150.221 g/mol |
SMILES | C1(=O)CC2=C(CC1)CCCC2 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.823396 |