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2H-1-Benzopyran-2-one, 3-(1,1-dimethyl-2-propenyl)-7-hydroxy-6-methoxy-
SpectraBase Compound ID Kpvs7voOSlN
InChI InChI=1S/C15H16O4/c1-5-15(2,3)10-6-9-7-13(18-4)11(16)8-12(9)19-14(10)17/h5-8,16H,1H2,2-4H3
InChIKey NEUWPSXOYGGGFO-UHFFFAOYSA-N
Mol Weight 260.29 g/mol
Molecular Formula C15H16O4
Exact Mass 260.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mVEkok5LsO
Name 2H-1-Benzopyran-2-one, 3-(1,1-dimethyl-2-propenyl)-7-hydroxy-6-methoxy-
Alternate Name(s) 3-(1,1-Dimethyl-2-propenyl)-7-hydroxy-6-methoxy-2H-chromen-2-one 3-(1',1'-Dimethylallyl)-7-hydroxy-6-methoxycoumarin 3-(1',1'-Dimethylallyl)scopoletin 3-(1,1-dimethyl-2-propenyl)-2-hydroxy-6-methoxy-7H-chromen-7-one 3-(1,1-Dimethylallyl)scopoletin Coumarin, 3-(1,1-dimethylallyl)-7-hydroxy-6-methoxy-
CAS Registry Number 19723-23-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O4
InChI InChI=1S/C15H16O4/c1-5-15(2,3)10-6-9-7-13(18-4)11(16)8-12(9)19-14(10)17/h5-8,16H,1H2,2-4H3
InChIKey NEUWPSXOYGGGFO-UHFFFAOYSA-N
Molecular Weight 260.289 g/mol
SMILES Oc1c(cc2c(c1)OC(C(=C2)C(C=C)(C)C)=O)OC
SPLASH splash10-07bb-0190000000-c4c33a928088cb7da61b
Source of Spectrum Y4-81-70-0
Wiley ID 1513315