SpectraBase Compound ID | IpIgRGqASl3 |
---|---|
InChI | InChI=1S/C12H16O/c1-12(2)10-6-4-3-5-9(10)7-8-11(12)13/h3-6,11,13H,7-8H2,1-2H3 |
InChIKey | RPCZAQCJGYOLJN-UHFFFAOYSA-N |
Mol Weight | 176.26 g/mol |
Molecular Formula | C12H16O |
Exact Mass | 176.120115 g/mol |
SpectraBase Spectrum ID | AdztXGsiKby |
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Name | 1,1-Dimethyl-1,2,3,4-tetrahydro-2-naphthol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 176.120115134 u |
Formula | C12H16O |
InChI | InChI=1S/C12H16O/c1-12(2)10-6-4-3-5-9(10)7-8-11(12)13/h3-6,11,13H,7-8H2,1-2H3 |
InChIKey | RPCZAQCJGYOLJN-UHFFFAOYSA-N |
Molecular Weight | 176.259 g/mol |
SMILES | C1(C(CCC=2C=CC=CC12)O)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.958629 |