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Heptanal, 3-hydroxy-2-methylene-6-(4-methylphenyl)-
SpectraBase Compound ID AKw1mYRlK7j
InChI InChI=1S/C15H20O2/c1-11-4-7-14(8-5-11)12(2)6-9-15(17)13(3)10-16/h4-5,7-8,10,12,15,17H,3,6,9H2,1-2H3
InChIKey MNUUJKQDJNCEHC-UHFFFAOYSA-N
Mol Weight 232.32 g/mol
Molecular Formula C15H20O2
Exact Mass 232.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AXBVO3cdCpl
Name Heptanal, 3-hydroxy-2-methylene-6-(4-methylphenyl)-
CAS Registry Number 54780-59-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O2
InChI InChI=1S/C15H20O2/c1-11-4-7-14(8-5-11)12(2)6-9-15(17)13(3)10-16/h4-5,7-8,10,12,15,17H,3,6,9H2,1-2H3
InChIKey MNUUJKQDJNCEHC-UHFFFAOYSA-N
Molecular Weight 232.323 g/mol
SMILES OC(C(=C)C=O)CCC(c1ccc(cc1)C)C
SPLASH splash10-014i-3900000000-39ec1b6d60b7dbe62645
Source of Spectrum AC-1981-311-0
Synonyms 2-[1-hydroxy-4-(4-methylphenyl)pentyl]acrylaldehyde 3-Hydroxy-2-methylene-6-p-tolyl-heptanal
Wiley ID 1234108