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5-Methoxypsoralen
SpectraBase Compound ID WJH5LggWn5
InChI InChI=1S/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H3
InChIKey BGEBZHIAGXMEMV-UHFFFAOYSA-N
Mol Weight 216.19 g/mol
Molecular Formula C12H8O4
Exact Mass 216.042259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K0Blw3xMXKe
Name Bergapten
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8O4
InChI InChI=1S/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H3
InChIKey BGEBZHIAGXMEMV-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 216.192 g/mol
SMILES COc1c2c(cc3c1C=CC(O3)=O)occ2
SPLASH splash10-01b9-3890000000-99aef07973adffd8d9d9
Source of Spectrum SRH-2022-7967-0
Synonyms 4-Methoxy-7h-furo(3,2-g)(1)benzopyran-7-one
Wiley ID 1829696