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2H-1-Benzopyran-2-one, 6-(2-hydroperoxy-3-methyl-3-butenyl)-7-methoxy-
SpectraBase Compound ID 7L2OSpPgY5G
InChI InChI=1S/C15H16O5/c1-9(2)12(20-17)7-11-6-10-4-5-15(16)19-14(10)8-13(11)18-3/h4-6,8,12,17H,1,7H2,2-3H3
InChIKey LZJVVLHCLPNUJM-UHFFFAOYSA-N
Mol Weight 276.29 g/mol
Molecular Formula C15H16O5
Exact Mass 276.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5IdVHKjs0m
Name 2H-1-Benzopyran-2-one, 6-(2-hydroperoxy-3-methyl-3-butenyl)-7-methoxy-
Alternate Name(s) Peroxytamarin 6-(2'-Hydroperoxy-3'-methylbut-3'-enyl)-7-methoxycoumarin 6-(2-hydroperoxy-3-methyl-3-butenyl)-7-methoxy-2H-chromen-2-one
CAS Registry Number 74794-72-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O5
InChI InChI=1S/C15H16O5/c1-9(2)12(20-17)7-11-6-10-4-5-15(16)19-14(10)8-13(11)18-3/h4-6,8,12,17H,1,7H2,2-3H3
InChIKey LZJVVLHCLPNUJM-UHFFFAOYSA-N
Molecular Weight 276.288 g/mol
SMILES OOC(C(=C)C)Cc1cc2c(OC(=O)C=C2)cc1OC
SPLASH splash10-052o-0920000000-1a2991c7c307295cb69a
Source of Spectrum E1-39-2512-1
Wiley ID 1519080