SpectraBase Compound ID | 1XA3CXWe4gM |
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InChI | InChI=1S/C16H24O2/c1-2-3-4-5-6-7-8-13-18-16-11-9-15(14-17)10-12-16/h9-12,14H,2-8,13H2,1H3 |
InChIKey | OZWJLGGZWZZBKK-UHFFFAOYSA-N |
Mol Weight | 248.37 g/mol |
Molecular Formula | C16H24O2 |
Exact Mass | 248.17763 g/mol |
SpectraBase Spectrum ID | Gyj6fVl1L7x |
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Name | p-Nonyloxybenzaldehyde |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 248.177630011 u |
Formula | C16H24O2 |
InChI | InChI=1S/C16H24O2/c1-2-3-4-5-6-7-8-13-18-16-11-9-15(14-17)10-12-16/h9-12,14H,2-8,13H2,1H3 |
InChIKey | OZWJLGGZWZZBKK-UHFFFAOYSA-N |
Molecular Weight | 248.366 g/mol |
SMILES | C1=CC(=CC=C1OCCCCCCCCC)C=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.814032 |