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2-(3'-d-Propargyl)-2,4,6-trimethyl-cyclohexa-3,5-dien-1-one
SpectraBase Compound ID HjuC1NeyOHz
InChI InChI=1S/C12H14O/c1-5-6-12(4)8-9(2)7-10(3)11(12)13/h1,7-8H,6H2,2-4H3/i1D
InChIKey OSGJCXSCNBSQSW-MICDWDOJSA-N
Mol Weight 175.25 g/mol
Molecular Formula C12H132DO
Exact Mass 175.110742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LYD2AFuaZpJ
Name 2-(3'-d-Propargyl)-2,4,6-trimethyl-cyclohexa-3,5-dien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13DO
InChI InChI=1S/C12H14O/c1-5-6-12(4)8-9(2)7-10(3)11(12)13/h1,7-8H,6H2,2-4H3/i1D
InChIKey OSGJCXSCNBSQSW-MICDWDOJSA-N
Literature Reference DOI 10.1002/hlca.19720550408
Molecular Weight 175.249 g/mol
SMILES C1(C(C=C(C=C1C)C)(C)CC#C[2D])=O
SPLASH splash10-002o-7900000000-a154d4e2ae7132c7484a
Source of Spectrum H-55-1135-3'_d_7
Synonyms 2,4,6-trimethyl-6-(prop-2-yn-1-yl-3-d)cyclohexa-2,4-dien-1-one
Wiley ID 1797023