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Sesamyl angelate
SpectraBase Compound ID HtS10vniRVO
InChI InChI=1S/C12H12O4/c1-3-8(2)12(13)16-9-4-5-10-11(6-9)15-7-14-10/h3-6H,7H2,1-2H3/b8-3-
InChIKey PVEAETPLCXLYRB-BAQGIRSFSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CSET4XdZ4JL
Name Sesamyl angelate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-3-8(2)12(13)16-9-4-5-10-11(6-9)15-7-14-10/h3-6H,7H2,1-2H3/b8-3-
InChIKey PVEAETPLCXLYRB-BAQGIRSFSA-N
Instrument Name HP 5890-5971
Ionization Type EI
Literature Reference DOI 10.1002/ffj.1968
Molecular Weight 220.224 g/mol
SMILES c1(OC(\C(=C/C)C)=O)ccc2c(c1)OCO2
SPLASH splash10-0a59-9200000000-aa020da731d261535c4e
Source of Spectrum 10.1002/ffj.1968
Wiley ID 1859250