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Octane-d18

View entire compound with spectra: 1 FTIR, 1 Raman, and 2 MS (GC)

Octane-d18
SpectraBase Compound ID 5iGZYclOHcY
InChI InChI=1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3/i1D3,2D3,3D2,4D2,5D2,6D2,7D2,8D2
InChIKey TVMXDCGIABBOFY-VAZJTQEUSA-N
Mol Weight 132.34 g/mol
Molecular Formula C8D18
Exact Mass 132.253832 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BK0cvxhEdum
Name Octane-D18
Alternate Name(s) (2H18)octane 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Octadecadeuteriooctane
CAS Registry Number 17252-77-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8D18
InChI InChI=1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3/i1D3,2D3,3D2,4D2,5D2,6D2,7D2,8D2
InChIKey TVMXDCGIABBOFY-VAZJTQEUSA-N
Molecular Weight 132.342 g/mol
SMILES C([D])(C([D])([D])[D])([D])C([D])([D])C([D])([D])C([D])([D])C([D])([D])C([D])([D])C([D])([D])[D]
SPLASH splash10-0uea-9000000000-de4b554ae53d3cc6612e
Wiley ID 1495105