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2H-1-Benzopyran-3-carbonitrile, 5-(acetyloxy)-2-oxo-7-pentyl-
SpectraBase Compound ID 2hq3sNbZlhR
InChI InChI=1S/C17H17NO4/c1-3-4-5-6-12-7-15(21-11(2)19)14-9-13(10-18)17(20)22-16(14)8-12/h7-9H,3-6H2,1-2H3
InChIKey GNUCHTWASKFNNX-UHFFFAOYSA-N
Mol Weight 299.33 g/mol
Molecular Formula C17H17NO4
Exact Mass 299.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLYGTdiV2mM
Name 2H-1-Benzopyran-3-carbonitrile, 5-(acetyloxy)-2-oxo-7-pentyl-
Alternate Name(s) 3-cyano-2-oxo-7-pentyl-2H-chromen-5-yl acetate 5-(ethanoyloxy)-2-oxo-7-pentyl-2H-1-oxanaphthalene-3-carbonitrile
CAS Registry Number 81482-18-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO4
InChI InChI=1S/C17H17NO4/c1-3-4-5-6-12-7-15(21-11(2)19)14-9-13(10-18)17(20)22-16(14)8-12/h7-9H,3-6H2,1-2H3
InChIKey GNUCHTWASKFNNX-UHFFFAOYSA-N
Molecular Weight 299.326 g/mol
SMILES C1(=Cc2c(OC(=O)C)cc(cc2OC1=O)CCCCC)C#N
SPLASH splash10-0zfr-0090000000-485c29c7076d43403138
Source of Spectrum I-60-314-0
Wiley ID 1302014