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Leptospermone <iso->
SpectraBase Compound ID 1JI04CSP1dl
InChI InChI=1S/C15H22O4/c1-7-8(2)10(16)9-11(17)14(3,4)13(19)15(5,6)12(9)18/h8-9H,7H2,1-6H3
InChIKey ZDZMTTISWJCOAE-UHFFFAOYSA-N
Mol Weight 266.34 g/mol
Molecular Formula C15H22O4
Exact Mass 266.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FFMUL2PwyWr
Name Leptospermone
CAS Registry Number 5009-05-2
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 266.151809184 u
Formula C15H22O4
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/C15H22O4/c1-7-8(2)10(16)9-11(17)14(3,4)13(19)15(5,6)12(9)18/h8-9H,7H2,1-6H3
InChIKey ZDZMTTISWJCOAE-UHFFFAOYSA-N
Molecular Weight 266.337 g/mol
Nominal Mass 266 u
Number of Peaks 214
SMILES C1(C(C(C(C(C1C(C(CC)C)=O)=O)(C)C)=O)(C)C)=O
SPLASH splash10-00kf-9540000000-75a49d7cad2f1a8ae183
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001819