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1-[5-Isopropyl-3-([2H3]methoxymethyl)-8-methylazulen-1-yl]ethanone
SpectraBase Compound ID L7CRP2cQGil
InChI InChI=1S/C18H22O2/c1-11(2)14-7-6-12(3)18-16(13(4)19)9-15(10-20-5)17(18)8-14/h6-9,11H,10H2,1-5H3/i5D3
InChIKey ZHOSHMIFKFSSLY-VPYROQPTSA-N
Mol Weight 273.39 g/mol
Molecular Formula C18H19D3O2
Exact Mass 273.18081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KTALijzu8ek
Name 1-[5-Isopropyl-3-([2H3]methoxymethyl)-8-methylazulen-1-yl]ethanone
Alternate Name(s) 1-(5-isopropyl-3-((methoxy-d3)methyl)-8-methylazulen-1-yl)ethan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19D3O2
InChI InChI=1S/C18H22O2/c1-11(2)14-7-6-12(3)18-16(13(4)19)9-15(10-20-5)17(18)8-14/h6-9,11H,10H2,1-5H3/i5D3
InChIKey ZHOSHMIFKFSSLY-VPYROQPTSA-N
Molecular Weight 273.390 g/mol
SMILES c1(c2c(ccc(C(C)C)cc2c(COC([D])([D])[D])c1)C)C(C)=O
SPLASH splash10-000i-0090000000-bc7f619d100d97ba6ac5
Source of Spectrum H-93-1561-Deuteriated_6
Wiley ID 1784077