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6,6,7,7-Tetradeuterio-undec-4-ene-1-carboxylic acid
SpectraBase Compound ID IgOwBIPRr6v
InChI InChI=1S/C12H22O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h7-8H,2-6,9-11H2,1H3,(H,13,14)/b8-7+/i5D2,6D2
InChIKey IJBFSOLHRKELLR-JGAMKYBXSA-N
Mol Weight 202.33 g/mol
Molecular Formula C12H182D4O2
Exact Mass 202.187087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GfRYMBs9luo
Name 6,6,7,7-Tetradeuterio-undec-4-ene-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18D4O2
InChI InChI=1S/C12H22O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h7-8H,2-6,9-11H2,1H3,(H,13,14)/b8-7+/i5D2,6D2
InChIKey IJBFSOLHRKELLR-JGAMKYBXSA-N
Molecular Weight 202.330 g/mol
SMILES OC(CCC\C=C\C(C(CCCC)([2D])[2D])([2D])[2D])=O
SPLASH splash10-03di-9300000000-b1575b0ab79500d987aa
Source of Spectrum U-1994-137-28
Wiley ID 765541