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PHACIDIN
SpectraBase Compound ID 7wVJMVK6yMB
InChI InChI=1S/C16H22O5/c1-3-4-5-6-7-8-9-13(18)15-10-14(19)12(11-17)16(20-2)21-15/h10-11H,3-9H2,1-2H3
InChIKey IQPOSHYXHRTFQM-UHFFFAOYSA-N
Mol Weight 294.35 g/mol
Molecular Formula C16H22O5
Exact Mass 294.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Tz27eZXMZh
Name 4H-Pyran-3-carboxaldehyde, 2-methoxy-4-oxo-6-(1-oxononyl)-
Alternate Name(s) 2-Methoxy-6-nonanoyl-4-oxo-4H-pyran-3-carbaldehyde 4H-pyran-5-carboxaldehyde, 6-methoxy-4-oxo-2-(1-oxononyl)- Phacidin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O5
InChI InChI=1S/C16H22O5/c1-3-4-5-6-7-8-9-13(18)15-10-14(19)12(11-17)16(20-2)21-15/h10-11H,3-9H2,1-2H3
InChIKey IQPOSHYXHRTFQM-UHFFFAOYSA-N
Molecular Weight 294.347 g/mol
SMILES C1(=C(OC(C(=O)CCCCCCCC)=CC1=O)OC)C=O
SPLASH splash10-0udi-3900000000-cfabeaec4eba0da520da
Source of Spectrum I-57-1451-0
Wiley ID 1297119