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3-Cyclohexene-1-carboxaldehyde, 4-methyl-
SpectraBase Compound ID H7ExeVVRUCF
InChI InChI=1S/C8H12O/c1-7-2-4-8(6-9)5-3-7/h2,6,8H,3-5H2,1H3
InChIKey YPHGCKOZJCGDTF-UHFFFAOYSA-N
Mol Weight 124.18 g/mol
Molecular Formula C8H12O
Exact Mass 124.088815 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID D8fo1jyqi4K
Name 1-Methylcyclohexene-4-carboxaldehyde; 3-cyclohexene-1-carboxaldehyde, 4-methyl-; 4-methyl-3-cyclohexenecarboxaldehyde
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 124.088815005 u
Formula C8H12O
InChI InChI=1S/C8H12O/c1-7-2-4-8(6-9)5-3-7/h2,6,8H,3-5H2,1H3
InChIKey YPHGCKOZJCGDTF-UHFFFAOYSA-N
Molecular Weight 124.183 g/mol
SMILES C1(CCC(=CC1)C)C=O
Spectrum/Structure Validation Score (Raman) 0.9922