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2-(2-propyl)-2-methyl-1,1,1-d(3)-1,3-dithiane

View entire compound with spectra: 1 MS (GC)

2-(2-propyl)-2-methyl-1,1,1-d(3)-1,3-dithiane
SpectraBase Compound ID Bwb9Wa2L9wm
InChI InChI=1S/C8H16S2/c1-7(2)8(3)9-5-4-6-10-8/h7H,4-6H2,1-3H3/i3D3
InChIKey XPYMFOATGVLTCH-HPRDVNIFSA-N
Mol Weight 179.35 g/mol
Molecular Formula C8H13D3S2
Exact Mass 179.088173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KXkE15PPB22
Name 2-(2-propyl)-2-methyl-1,1,1-d(3)-1,3-dithiane
CAS Registry Number 119336-34-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13D3S2
InChI InChI=1S/C8H16S2/c1-7(2)8(3)9-5-4-6-10-8/h7H,4-6H2,1-3H3/i3D3
InChIKey XPYMFOATGVLTCH-HPRDVNIFSA-N
Molecular Weight 179.354 g/mol
SMILES C1(SCCCS1)(C(C)C)C([D])([D])[D]
SPLASH splash10-000i-0900000000-05333cfbaf9762101072
Source of Spectrum J-54-1708-0
Wiley ID 1172073