For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(E)-3-(7-hydroxy-2-keto-3,4-dimethyl-chromen-6-yl)but-2-enoic acid ethyl ester
SpectraBase Compound ID 7pGwobetnQ0
InChI InChI=1S/C17H18O5/c1-5-21-16(19)6-9(2)12-7-13-10(3)11(4)17(20)22-15(13)8-14(12)18/h6-8,18H,5H2,1-4H3/b9-6+
InChIKey NFKBBDIKPAGMPJ-RMKNXTFCSA-N
Mol Weight 302.33 g/mol
Molecular Formula C17H18O5
Exact Mass 302.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 86oKVWQEoo2
Name (E)-3-(7-hydroxy-2-keto-3,4-dimethyl-chromen-6-yl)but-2-enoic acid ethyl ester
Alternate Name(s) (E)-3-(7-hydroxy-3,4-dimethyl-2-oxo-1-benzopyran-6-yl)-2-butenoic acid ethyl ester Ethyl (E)-3-(3,4-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-6-yl)but-2-enoate Ethyl (E)-3-(7-hydroxy-3,4-dimethyl-2-oxo-chromen-6-yl)but-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O5
InChI InChI=1S/C17H18O5/c1-5-21-16(19)6-9(2)12-7-13-10(3)11(4)17(20)22-15(13)8-14(12)18/h6-8,18H,5H2,1-4H3/b9-6+
InChIKey NFKBBDIKPAGMPJ-RMKNXTFCSA-N
Molecular Weight 302.326 g/mol
SMILES Oc1c(cc2C(=C(C(Oc2c1)=O)C)C)\C(=C\C(=O)OCC)C
SPLASH splash10-0pdi-0091000000-4c4531c57dd4bd1f2988
Source of Spectrum Y-31-176-5
Wiley ID 761426