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3-[Hydroxy(3-phenoxyphenyl)methyl]-4-iodo-(Z)-3-buten-2-one
SpectraBase Compound ID KNRHQtATRb2
InChI InChI=1S/C17H15IO3/c1-12(19)16(11-18)17(20)13-6-5-9-15(10-13)21-14-7-3-2-4-8-14/h2-11,17,20H,1H3/b16-11+
InChIKey BLPGQXYNBXTAIQ-LFIBNONCSA-N
Mol Weight 394.21 g/mol
Molecular Formula C17H15IO3
Exact Mass 394.006589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9dsetRRLXhi
Name 3-[Hydroxy(3-phenoxyphenyl)methyl]-4-iodo-(Z)-3-buten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15IO3
InChI InChI=1S/C17H15IO3/c1-12(19)16(11-18)17(20)13-6-5-9-15(10-13)21-14-7-3-2-4-8-14/h2-11,17,20H,1H3/b16-11+
InChIKey BLPGQXYNBXTAIQ-LFIBNONCSA-N
Molecular Weight 394.208 g/mol
SMILES OC(\C(C(=O)C)=C\I)c1cc(Oc2ccccc2)ccc1
SPLASH splash10-000x-9000000000-a17b8fa866a9fb5e1544
Source of Spectrum C5-2005-59-3
Synonyms (3Z)-3-[hydroxy(3-phenoxyphenyl)methyl]-4-iodo-3-buten-2-one
Wiley ID 1617911