SpectraBase Compound ID | 48lTJfICtfJ |
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InChI | InChI=1S/C10H12O2/c1-8-9(6-11)4-3-5-10(8)7-12-2/h3-6H,7H2,1-2H3 |
InChIKey | UEDPEAGIXKZFDU-UHFFFAOYSA-N |
Mol Weight | 164.2 g/mol |
Molecular Formula | C10H12O2 |
Exact Mass | 164.08373 g/mol |
SpectraBase Spectrum ID | DlgxQYIJo5h |
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Name | 3-(Methoxymethyl)-2-methylbenzaldehyde |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 164.083729624 u |
Formula | C10H12O2 |
InChI | InChI=1S/C10H12O2/c1-8-9(6-11)4-3-5-10(8)7-12-2/h3-6H,7H2,1-2H3 |
InChIKey | UEDPEAGIXKZFDU-UHFFFAOYSA-N |
Molecular Weight | 164.204 g/mol |
SMILES | C=1(C(C=O)=CC=CC1COC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.877863 |