SpectraBase Compound ID | 7ONnXuHXex6 |
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InChI | InChI=1S/C10H14O/c1-8-4-3-5-10(6-8)9(2)7-11/h3-6,9,11H,7H2,1-2H3 |
InChIKey | RMKUOUCSEVQHSS-UHFFFAOYSA-N |
Mol Weight | 150.22 g/mol |
Molecular Formula | C10H14O |
Exact Mass | 150.104465 g/mol |
SpectraBase Spectrum ID | E2b3HIfBCJs |
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Name | 2-(3-Methylphenyl)propan-1-ol |
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/c1-8-4-3-5-10(6-8)9(2)7-11/h3-6,9,11H,7H2,1-2H3 |
InChIKey | RMKUOUCSEVQHSS-UHFFFAOYSA-N |
Molecular Weight | 150.221 g/mol |
SMILES | C(C(C)C=1C=C(C=CC1)C)O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.902615 |