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Osthole
SpectraBase Compound ID FUyJ0V15gKA
InChI InChI=1S/C15H16O3/c1-10(2)4-7-12-13(17-3)8-5-11-6-9-14(16)18-15(11)12/h4-6,8-9H,7H2,1-3H3
InChIKey MBRLOUHOWLUMFF-UHFFFAOYSA-N
Mol Weight 244.29 g/mol
Molecular Formula C15H16O3
Exact Mass 244.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4imcX6Tg96j
Name 2H-1-Benzopyran-2-one, 7-methoxy-8-(3-methyl-2-butenyl)-
CAS Registry Number 484-12-8
Classification Coumarins and derivatives
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 244.109944372 u
Formula C15H16O3
InChI InChI=1S/C15H16O3/c1-10(2)4-7-12-13(17-3)8-5-11-6-9-14(16)18-15(11)12/h4-6,8-9H,7H2,1-3H3
InChIKey MBRLOUHOWLUMFF-UHFFFAOYSA-N
Molecular Weight 244.290 g/mol
Number of Peaks 17
SMILES c1c(c(CC=C(C)C)c2OC(C=Cc2c1)=O)OC
SPLASH splash10-004u-0390000000-033feb8dfa1670e3948f
Source of Spectrum FF-22-355-355_27 (DOI: 10.1002/ffj.1804)
Synonyms Coumarin, 7-methoxy-8-(3-methyl-2-butenyl)- Osthole 7-Methoxy-8-(3-methyl-2-butenyl)-2H-chromen-2-one 7-Methoxy-8-(3-methyl-2-butenyl)-coumarin 7-Methoxy-8-(3-methylbut-2-enyl)-1-benzopyran-2-one 7-Methoxy-8-(3-methylbut-2-enyl)chromen-2-one Osthol 7-Methoxy-8-(3-methylbut-2-enyl)coumarin 7-Methoxy-8-isopentenylcoumarin 8-(3-Methyl-2-butenyl)herniarin Ostol Ostole 7-Methoxy-8-(3-methylbut-2-en-1-yl)-2H-chromen-2-one NSC 31868
Wiley ID 1775481