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5-(2',3',5',6'-Tetradeuterioocta-2',5'-dien-1'-yl)-4,5-dideuteriotetrahydrofuran-2-one
SpectraBase Compound ID B5IHi6Gjl6K
InChI InChI=1S/C12H18O2/c1-2-3-4-5-6-7-8-11-9-10-12(13)14-11/h3-4,6-7,11H,2,5,8-10H2,1H3/b4-3-,7-6-/i3D,4D,6D,7D,9D,11D
InChIKey YNHBLISDDXOUDQ-MCVZIFHCSA-N
Mol Weight 200.31 g/mol
Molecular Formula C12H12D6O2
Exact Mass 200.16834 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EWmjU4uhdFV
Name 5-(2',3',5',6'-Tetradeuterioocta-2',5'-dien-1'-yl)-4,5-dideuteriotetrahydrofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12D6O2
InChI InChI=1S/C12H18O2/c1-2-3-4-5-6-7-8-11-9-10-12(13)14-11/h3-4,6-7,11H,2,5,8-10H2,1H3/b4-3-,7-6-/i3D,4D,6D,7D,9D,11D
InChIKey YNHBLISDDXOUDQ-MCVZIFHCSA-N
Molecular Weight 200.311 g/mol
SMILES C1(OC(=O)CC1[D])(C\C(=C/(C\C(=C/([D])CC)[D])[D])[D])[D]
SPLASH splash10-000j-9100000000-8195f9ce74e17e68b366
Source of Spectrum H-79-2092-0
Wiley ID 1191274