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PSEUDOPYRONINE_A
SpectraBase Compound ID F2jCtlKJ3i9
InChI InChI=1S/C16H26O3/c1-3-5-7-9-11-14-15(17)12-13(19-16(14)18)10-8-6-4-2/h12,17H,3-11H2,1-2H3
InChIKey SWHSFCDMQYUTEL-UHFFFAOYSA-N
Mol Weight 266.38 g/mol
Molecular Formula C16H26O3
Exact Mass 266.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4incuDCL0pC
Name Pseudopyronine A
Alternate Name(s) 3-Hexyl-4-hydroxy-6-pentyl-2H-pyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O3
InChI InChI=1S/C16H26O3/c1-3-5-7-9-11-14-15(17)12-13(19-16(14)18)10-8-6-4-2/h12,17H,3-11H2,1-2H3
InChIKey SWHSFCDMQYUTEL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201203180
Molecular Weight 266.381 g/mol
SMILES OC1=C(C(OC(CCCCC)=C1)=O)CCCCCC
SPLASH splash10-0002-3920000000-58c9bd629de316043c5a
Source of Spectrum ACI-51-SMS3-7g
Wiley ID 1780398