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4-(2-keto-7-methoxy-chromene-3-carbonyl)benzonitrile
SpectraBase Compound ID hUcVAyb4xx
InChI InChI=1S/C18H11NO4/c1-22-14-7-6-13-8-15(18(21)23-16(13)9-14)17(20)12-4-2-11(10-19)3-5-12/h2-9H,1H3
InChIKey LXQFUGZQXPUIFL-UHFFFAOYSA-N
Mol Weight 305.29 g/mol
Molecular Formula C18H11NO4
Exact Mass 305.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CztwGOUBAOP
Name 4-(2-keto-7-methoxy-chromene-3-carbonyl)benzonitrile
Alternate Name(s) 4-(7-Methoxy-2-oxidanylidene-chromen-3-yl)carbonylbenzenecarbonitrile 4-(7-Methoxy-2-oxo-chromene-3-carbonyl)benzonitrile 4-[(7-methoxy-2-oxo-1-benzopyran-3-yl)-oxomethyl]benzonitrile
CAS Registry Number 83204-56-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11NO4
InChI InChI=1S/C18H11NO4/c1-22-14-7-6-13-8-15(18(21)23-16(13)9-14)17(20)12-4-2-11(10-19)3-5-12/h2-9H,1H3
InChIKey LXQFUGZQXPUIFL-UHFFFAOYSA-N
Molecular Weight 305.289 g/mol
SMILES C=1(C(Oc2c(C1)ccc(OC)c2)=O)C(c1ccc(C#N)cc1)=O
SPLASH splash10-0pdi-0596000000-b01190f0bfd18ea9b50b
Source of Spectrum F-38-1210-0
Wiley ID 1307375