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Eupatoriochromene
SpectraBase Compound ID JlfnIuIm53w
InChI InChI=1S/C13H14O3/c1-8(14)10-6-9-4-5-13(2,3)16-12(9)7-11(10)15/h4-7,15H,1-3H3
InChIKey SVUVYHFYZBCYRF-UHFFFAOYSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ew2SpHA2U9G
Name Eupatoriochromene
CAS Registry Number 19013-03-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O3
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C13H14O3/c1-8(14)10-6-9-4-5-13(2,3)16-12(9)7-11(10)15/h4-7,15H,1-3H3
InChIKey SVUVYHFYZBCYRF-UHFFFAOYSA-N
Molecular Weight 218.252 g/mol
SMILES Oc1c(C(C)=O)cc2C=CC(Oc2c1)(C)C
SPLASH splash10-0udi-3390000000-4d7786ec01b3e51a1730
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886327