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4-Hexen-1-yn-3-one-1-d, 5-methyl-
SpectraBase Compound ID 4QfdHtstLl0
InChI InChI=1S/C7H8O/c1-4-7(8)5-6(2)3/h1,5H,2-3H3/i1D
InChIKey MZYGNQKBISSLSL-MICDWDOJSA-N
Mol Weight 109.15 g/mol
Molecular Formula C7H7DO
Exact Mass 109.063792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8AQgxCisgJZ
Name 4-Hexen-1-yn-3-one-1-d, 5-methyl-
Alternate Name(s) 5-Methyl(1-deuterio)hex-4-en-1-yn-3-one
CAS Registry Number 105365-02-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7DO
InChI InChI=1S/C7H8O/c1-4-7(8)5-6(2)3/h1,5H,2-3H3/i1D
InChIKey MZYGNQKBISSLSL-MICDWDOJSA-N
Molecular Weight 109.146 g/mol
SMILES C(#C[D])C(C=C(C)C)=O
SPLASH splash10-0006-9000000000-b2e23d579bb2d83c45a3
Source of Spectrum H-69-577-36
Wiley ID 1121880