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2-Propenal, 3-[4-[(4-hydroxy-3-methyl-2-butenyl)oxy]phenyl]-, (E,E)-
SpectraBase Compound ID BFYlsappSaL
InChI InChI=1S/C14H16O3/c1-12(11-16)8-10-17-14-6-4-13(5-7-14)3-2-9-15/h2-9,16H,10-11H2,1H3/b3-2+,12-8+
InChIKey WTPJBDXPQRVSMI-NQPRBDNZSA-N
Mol Weight 232.28 g/mol
Molecular Formula C14H16O3
Exact Mass 232.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LhMcdX99Qfq
Name 2-Propenal, 3-[4-[(4-hydroxy-3-methyl-2-butenyl)oxy]phenyl]-, (E,E)-
CAS Registry Number 73213-62-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O3
InChI InChI=1S/C14H16O3/c1-12(11-16)8-10-17-14-6-4-13(5-7-14)3-2-9-15/h2-9,16H,10-11H2,1H3/b3-2+,12-8+
InChIKey WTPJBDXPQRVSMI-NQPRBDNZSA-N
Molecular Weight 232.279 g/mol
SMILES OC\C(=C\COc1ccc(\C=C\C=O)cc1)C
SPLASH splash10-0002-0900000000-9c888749fb77e80bd994
Source of Spectrum KC-1982-2054-0
Synonyms (2E)-3-(4-{[(2E)-4-hydroxy-3-methyl-2-butenyl]oxy}phenyl)-2-propenal Boninenal
Wiley ID 1233921