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6-(2-BROMO-2-BUTANOYL)-5-METHOXY-8,8-DIMETHYL-4-PROPYL-2H,8H-BENZO-[1,2-B:3,4-B']-DIPYRAN-2-ONE
SpectraBase Compound ID AwWgtlDaCfg
InChI InChI=1S/C23H27BrO5/c1-7-9-13-12-15(25)28-18-14-10-11-22(3,4)29-19(14)17(20(27-6)16(13)18)21(26)23(5,24)8-2/h10-12H,7-9H2,1-6H3
InChIKey CDNOSBKWVIETDC-UHFFFAOYSA-N
Mol Weight 463.37 g/mol
Molecular Formula C23H27BrO5
Exact Mass 462.104187 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8tWFrQbBaGh
Name 6-(2-Bromo-2-methylbutanoyl)-5-methoxy-8,8-dimethyl-4-propyl-2H,8H-benzo[1,2-b:3,4-b']dipyran-2-one
Alternate Name(s) 6-(2-bromo-2-methylbutanoyl)-5-methoxy-8,8-dimethyl-4-propyl-2H,8H-pyrano[2,3-f]chromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27BrO5
InChI InChI=1S/C23H27BrO5/c1-7-9-13-12-15(25)28-18-14-10-11-22(3,4)29-19(14)17(20(27-6)16(13)18)21(26)23(5,24)8-2/h10-12H,7-9H2,1-6H3
InChIKey CDNOSBKWVIETDC-UHFFFAOYSA-N
Molecular Weight 463.368 g/mol
SMILES c1(c2c(C=CC(O2)(C)C)c2c(c1OC)C(=CC(O2)=O)CCC)C(C(Br)(CC)C)=O
SPLASH splash10-004i-0009500000-331058eb3173ef2e0c08
Source of Spectrum KC-0-3145-50
Wiley ID 784689