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2-methylbutyric acid [4-methoxy-2-(3-methyloxiran-2-yl)phenyl] ester
SpectraBase Compound ID FI838PCrmj
InChI InChI=1S/C15H20O4/c1-5-9(2)15(16)19-13-7-6-11(17-4)8-12(13)14-10(3)18-14/h6-10,14H,5H2,1-4H3
InChIKey VXWVNVFBEJTTKA-UHFFFAOYSA-N
Mol Weight 264.32 g/mol
Molecular Formula C15H20O4
Exact Mass 264.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fxytLpULQ
Name Epoxy-pseudoisoeugenyl 2-methylbutyrate
CAS Registry Number 104283-18-3
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 264.136159120 u
Formula C15H20O4
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C15H20O4/c1-5-9(2)15(16)19-13-7-6-11(17-4)8-12(13)14-10(3)18-14/h6-10,14H,5H2,1-4H3
InChIKey VXWVNVFBEJTTKA-UHFFFAOYSA-N
Molecular Weight 264.321 g/mol
Nominal Mass 264 u
Number of Peaks 109
SMILES COc1ccc(c(c1)C1C(O1)C)OC(=O)C(CC)C
SPLASH splash10-0bti-8900000000-a690a73a67f5321786cf
Source ex PIMPINELLA PEREGRINA ROOTS, ex KUBECZKA
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA000525