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4-Methoxy-5-carbomethoxy-6-pentyl-2H-pyran-2-one
SpectraBase Compound ID 38sMBGxokCZ
InChI InChI=1S/C13H18O5/c1-4-5-6-7-9-12(13(15)17-3)10(16-2)8-11(14)18-9/h8H,4-7H2,1-3H3
InChIKey YJADFPIZQHEYNC-UHFFFAOYSA-N
Mol Weight 254.28 g/mol
Molecular Formula C13H18O5
Exact Mass 254.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C03LQnGUnsq
Name 4-Methoxy-5-carbomethoxy-6-pentyl-2H-pyran-2-one
Appearance Colorless needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O5
InChI InChI=1S/C13H18O5/c1-4-5-6-7-9-12(13(15)17-3)10(16-2)8-11(14)18-9/h8H,4-7H2,1-3H3
InChIKey YJADFPIZQHEYNC-UHFFFAOYSA-N
Instrument Name JEOL JMS AX-500
Ionization Type EI
Literature Reference DOI 10.1021/np020301h
Molecular Weight 254.282 g/mol
Reported Formula C13H18O5
SMILES COC1=CC(OC(=C1C(OC)=O)CCCCC)=O
SPLASH splash10-0gc1-0920000000-fae6b07db918c5501219
Source of Spectrum G4-65-1873-3
Wiley ID 1883566