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2-[6-(3,4-Methylenedioxyphenyl)hexyl]-5-hydroxy-4-chromanone
SpectraBase Compound ID 1TCFp8LKRFH
InChI InChI=1S/C22H24O5/c23-17-8-5-9-20-22(17)18(24)13-16(27-20)7-4-2-1-3-6-15-10-11-19-21(12-15)26-14-25-19/h5,8-12,16,23H,1-4,6-7,13-14H2
InChIKey WVTVOWRTDARJOX-UHFFFAOYSA-N
Mol Weight 368.43 g/mol
Molecular Formula C22H24O5
Exact Mass 368.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 15lpUFYlG4
Name 2-[6-(3,4-Methylenedioxyphenyl)hexyl]-5-hydroxy-4-chromanone
Alternate Name(s) 2-[6-(1,3-benzodioxol-5-yl)hexyl]-5-hydroxy-2,3-dihydro-4H-chromen-4-one 2-[6-(1,3-benzodioxol-5-yl)hexyl]-5-hydroxy-3,4-dihydro-2H-1-benzopyran-4-one 2-[6-(1,3-benzodioxol-5-yl)hexyl]-5-hydroxy-2,3-dihydrochromen-4-one 2-[6-(1,3-benzodioxol-5-yl)hexyl]-5-oxidanyl-2,3-dihydrochromen-4-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24O5
InChI InChI=1S/C22H24O5/c23-17-8-5-9-20-22(17)18(24)13-16(27-20)7-4-2-1-3-6-15-10-11-19-21(12-15)26-14-25-19/h5,8-12,16,23H,1-4,6-7,13-14H2
InChIKey WVTVOWRTDARJOX-UHFFFAOYSA-N
Molecular Weight 368.429 g/mol
SMILES Oc1c2C(CC(Oc2ccc1)CCCCCCc1cc2c(cc1)OCO2)=O
SPLASH splash10-02t9-0709000000-95403e0947119ca952e7
Source of Spectrum E1-39-22-10
Wiley ID 1518656