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Homoisobaeckeol
SpectraBase Compound ID 6XtDKqkZmjp
InChI InChI=1S/C14H20O4/c1-6-8(2)13(16)12-10(15)7-11(17-4)9(3)14(12)18-5/h7-8,15H,6H2,1-5H3
InChIKey VOROJSRPXRHKKG-UHFFFAOYSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Auf3YX5CC
Name Homoisobaeckeol
CAS Registry Number 808751-13-5
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 252.136159120 u
Formula C14H20O4
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/C14H20O4/c1-6-8(2)13(16)12-10(15)7-11(17-4)9(3)14(12)18-5/h7-8,15H,6H2,1-5H3
InChIKey VOROJSRPXRHKKG-UHFFFAOYSA-N
Molecular Weight 252.310 g/mol
Nominal Mass 252 u
Number of Peaks 154
SMILES COc1cc(c(c(c1C)OC)C(C(CC)C)=O)O
SPLASH splash10-0002-3900000000-dafd327821b4d0f24e54
Source ex EUCALYPTUS MINUTA
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA000693