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1,5,9-Cyclododecatriene, 1,2,3,3,4,4,5,6,7,7,12,12-dodecadeutero-
SpectraBase Compound ID GoOYNEN2GvO
InChI InChI=1S/C12H18/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-2,7-10H,3-6,11-12H2/b2-1-,9-7-,10-8+/i1D,2D,3D2,4D2,5D2,7D,9D,11D2
InChIKey ZOLLIQAKMYWTBR-WHSXRHAWSA-N
Mol Weight 174.35 g/mol
Molecular Formula C12H6D12
Exact Mass 174.216172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tAaMJDnsXc
Name 1,5,9-Cyclododecatriene, 1,2,3,3,4,4,5,6,7,7,12,12-dodecadeutero-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H6D12
InChI InChI=1S/C12H18/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-2,7-10H,3-6,11-12H2/b2-1-,9-7-,10-8+/i1D,2D,3D2,4D2,5D2,7D,9D,11D2
InChIKey ZOLLIQAKMYWTBR-WHSXRHAWSA-N
Molecular Weight 174.349 g/mol
SMILES C1(\C([D])=C/(C(C(\C(=C/(C(C\C=C\C1)([D])[D])[D])[D])([D])[D])([D])[D])[D])([D])[D]
SPLASH splash10-0ik9-9100000000-1ae91257e01fb7b0acb0
Source of Spectrum HE-1982-0-0
Wiley ID 1159172