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3-(1-Hydroxy-3-oxobutadienyl)-7-methoxy-3,4-dehydrochroman-2-one
SpectraBase Compound ID 2luBQSDbbjr
InChI InChI=1S/C14H12O5/c1-8(15)5-12(16)11-6-9-3-4-10(18-2)7-13(9)19-14(11)17/h3-7,16H,1-2H3/b12-5-
InChIKey LLMZXUQPXVTNMD-XGICHPGQSA-N
Mol Weight 260.24 g/mol
Molecular Formula C14H12O5
Exact Mass 260.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CRLi5B9tdtf
Name 3-(1-Hydroxy-3-oxobutadienyl)-7-methoxy-3,4-dehydrochroman-2-one
Alternate Name(s) 3-[(Z)-1-hydroxy-3-oxobut-1-enyl]-7-methoxy-1-benzopyran-2-one 3-[(Z)-1-hydroxy-3-oxobut-1-enyl]-7-methoxychromen-2-one 3-[(Z)-1-hydroxy-3-oxo-but-1-enyl]-7-methoxy-chromen-2-one 7-Methoxy-3-[(Z)-1-oxidanyl-3-oxidanylidene-but-1-enyl]chromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12O5
InChI InChI=1S/C14H12O5/c1-8(15)5-12(16)11-6-9-3-4-10(18-2)7-13(9)19-14(11)17/h3-7,16H,1-2H3/b12-5-
InChIKey LLMZXUQPXVTNMD-XGICHPGQSA-N
Molecular Weight 260.245 g/mol
SMILES O\C(C=1C(Oc2cc(OC)ccc2C1)=O)=C/C(=O)C
SPLASH splash10-0udi-0090000000-679f2eb725ccd1b867b8
Source of Spectrum AT-42-3286-19
Wiley ID 855137