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1H-2-Benzopyran-1-one, 6-methoxy-3-pentyl-
SpectraBase Compound ID Ay5KMWPYCXy
InChI InChI=1S/C15H18O3/c1-3-4-5-6-13-10-11-9-12(17-2)7-8-14(11)15(16)18-13/h7-10H,3-6H2,1-2H3
InChIKey JVLPZAWOGIAELP-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eq5EnFLU3Y
Name 1H-2-Benzopyran-1-one, 6-methoxy-3-pentyl-
Alternate Name(s) 6-Methoxy-3-pentyl-1H-2-benzopyran-1-one
CAS Registry Number 58005-80-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-3-4-5-6-13-10-11-9-12(17-2)7-8-14(11)15(16)18-13/h7-10H,3-6H2,1-2H3
InChIKey JVLPZAWOGIAELP-UHFFFAOYSA-N
Molecular Weight 246.306 g/mol
SMILES C1(OC(CCCCC)=Cc2c1ccc(OC)c2)=O
SPLASH splash10-0002-0970000000-fe44d388b5b802322885
Source of Spectrum B-28-1577-0
Wiley ID 1249157