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Pinane (3-d1)
SpectraBase Compound ID Eoaig8elKHH
InChI InChI=1S/C10H18/c1-7-4-5-8-6-9(7)10(8,2)3/h7-9H,4-6H2,1-3H3/t7-,8+,9+/m0/s1/i4D/t4?,7-,8+,9+
InChIKey XOKSLPVRUOBDEW-APSRPVFFSA-N
Mol Weight 139.26 g/mol
Molecular Formula C10H172H
Exact Mass 139.147127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E16ZpvGz7iH
Name Pinane (3-d1)
Alternate Name(s) 2,6,6-Trimethylbicyclo(3.1.1)heptane (3-d1)
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Formula C10H17D
InChI InChI=1S/C10H18/c1-7-4-5-8-6-9(7)10(8,2)3/h7-9H,4-6H2,1-3H3/t7-,8+,9+/m0/s1/i4D/t4?,7-,8+,9+
InChIKey XOKSLPVRUOBDEW-APSRPVFFSA-N
Ionization Type EI-B
Molecular Weight 139.260 g/mol
SMILES C1([2H])C[C@]2(C([C@@]([C@]1(C)[H])(C2)[H])(C)C)[H]
SPLASH splash10-05o1-9000000000-d08b9650823025bce16a
Source of Spectrum SRH-2022-7400-0
Wiley ID 1829196