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Cyclohexene, 4-ethenyl-, perdeuterated
SpectraBase Compound ID 28iScE3cABj
InChI InChI=1S/C8H12/c1-2-8-6-4-3-5-7-8/h2-4,8H,1,5-7H2/i1D2,2D,3D,4D,5D2,6D2,7D2,8D
InChIKey BBDKZWKEPDTENS-UIWOONHCSA-N
Mol Weight 120.26 g/mol
Molecular Formula C8D12
Exact Mass 120.169221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9VsYWVYMZ4G
Name Cyclohexene, 4-ethenyl-, perdeuterated
Alternate Name(s) 1,2,3,3,4,5,5,6,6-D9-1-Cyclohexene, 4-D3-vinyl-
CAS Registry Number 100-40-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8D12
InChI InChI=1S/C8H12/c1-2-8-6-4-3-5-7-8/h2-4,8H,1,5-7H2/i1D2,2D,3D,4D,5D2,6D2,7D2,8D
InChIKey BBDKZWKEPDTENS-UIWOONHCSA-N
Molecular Weight 120.257 g/mol
SMILES C1(C(C(C([D])=C(C1([D])[D])[D])([D])[D])([D])[D])(C(=C([D])[D])[D])[D]
SPLASH splash10-03ki-9000000000-68a6a2d718ec1ddbe8f4
Source of Spectrum HE-1982-0-0
Wiley ID 1122054