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1-Hydroxy-3-methyl-4-phenylbut-3-en-2-one
SpectraBase Compound ID 4b4cCxPMkvS
InChI InChI=1S/C11H12O2/c1-9(11(13)8-12)7-10-5-3-2-4-6-10/h2-7,12H,8H2,1H3/b9-7+
InChIKey QWGYWFWVMTYHTR-VQHVLOKHSA-N
Mol Weight 176.21 g/mol
Molecular Formula C11H12O2
Exact Mass 176.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4UUjtauL9SQ
Name 1-Hydroxy-3-methyl-4-phenylbut-3-en-2-one
Alternate Name(s) (E)-1-hydroxy-3-methyl-4-phenylbut-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O2
InChI InChI=1S/C11H12O2/c1-9(11(13)8-12)7-10-5-3-2-4-6-10/h2-7,12H,8H2,1H3/b9-7+
InChIKey QWGYWFWVMTYHTR-VQHVLOKHSA-N
Literature Reference DOI 10.1002/adsc.200700550
Molecular Weight 176.215 g/mol
SMILES OCC(\C(=C\c1ccccc1)C)=O
SPLASH splash10-00kb-0900000000-d2dd551aaf0539b8f4ad
Source of Spectrum ASC-350-759/SM7-10b
Wiley ID 1766086