SpectraBase Compound ID | EmPtA9Xm9Ok |
---|---|
InChI | InChI=1S/C11H16O2/c1-9(2)10-3-5-11(6-4-10)13-8-7-12/h3-6,9,12H,7-8H2,1-2H3 |
InChIKey | ZMWWUPALOIERNV-UHFFFAOYSA-N |
Mol Weight | 180.25 g/mol |
Molecular Formula | C11H16O2 |
Exact Mass | 180.11503 g/mol |
SpectraBase Spectrum ID | EsuurpfleRz |
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Name | Ethanol, 2-[4-(1-methylethyl)phenoxy]- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 180.115029753 u |
Formula | C11H16O2 |
InChI | InChI=1S/C11H16O2/c1-9(2)10-3-5-11(6-4-10)13-8-7-12/h3-6,9,12H,7-8H2,1-2H3 |
InChIKey | ZMWWUPALOIERNV-UHFFFAOYSA-N |
Molecular Weight | 180.247 g/mol |
SMILES | CC(C)C1=CC=C(C=C1)OCCO |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.95471 |