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2-Propenal, 3-[4-(1,1-dimethylethyl)phenyl]-
SpectraBase Compound ID Cu1zxdQHnCj
InChI InChI=1S/C13H16O/c1-13(2,3)12-8-6-11(7-9-12)5-4-10-14/h4-10H,1-3H3/b5-4+
InChIKey ICSATJUWLAEQQU-SNAWJCMRSA-N
Mol Weight 188.27 g/mol
Molecular Formula C13H16O
Exact Mass 188.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lq1PhdySzhK
Name 2-Propenal, 3-[4-(1,1-dimethylethyl)phenyl]-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H16O
InChI InChI=1S/C13H16O/c1-13(2,3)12-8-6-11(7-9-12)5-4-10-14/h4-10H,1-3H3/b5-4+
InChIKey ICSATJUWLAEQQU-SNAWJCMRSA-N
Molecular Weight 188.1197
SMILES CC(c1ccc(\C=C\C=O)cc1)(C)C
SPLASH splash10-0089-3900000000-9b91703a69da3bc39e47
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany