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3-[2'-(4"-Oxopentyl)phenyl]but-2-enal
SpectraBase Compound ID BkZnP5mgwJE
InChI InChI=1S/C15H18O2/c1-12(10-11-16)15-9-4-3-7-14(15)8-5-6-13(2)17/h3-4,7,9-11H,5-6,8H2,1-2H3/b12-10+
InChIKey SQDJXYLPNHYNRD-ZRDIBKRKSA-N
Mol Weight 230.31 g/mol
Molecular Formula C15H18O2
Exact Mass 230.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID no4Z2MYSFs
Name 3-[2'-(4"-Oxopentyl)phenyl]but-2-enal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O2
InChI InChI=1S/C15H18O2/c1-12(10-11-16)15-9-4-3-7-14(15)8-5-6-13(2)17/h3-4,7,9-11H,5-6,8H2,1-2H3/b12-10+
InChIKey SQDJXYLPNHYNRD-ZRDIBKRKSA-N
Molecular Weight 230.307 g/mol
SMILES c1(\C(=C\C=O)C)c(CCCC(=O)C)cccc1
SPLASH splash10-0006-2900000000-65dee09004b67b05b99f
Source of Spectrum H-82-596-13.2
Synonyms 3-[2'-(4''-Oxopentyl)phenyl]but-2-enal
Wiley ID 815283