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(1S,6S)-2-Acetoxy-9-deuteriobicyclo[4.4.0]dec-2-ene
SpectraBase Compound ID IGAKINlsBnd
InChI InChI=1S/C12H18O2/c1-9(13)14-12-8-4-6-10-5-2-3-7-11(10)12/h8,10-11H,2-7H2,1H3/t10-,11-/m0/s1/i3D/t3?,10-,11-
InChIKey VZVJQGFRRBDHDE-GNZNFKPISA-N
Mol Weight 195.28 g/mol
Molecular Formula C12H17DO2
Exact Mass 195.136957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DGOKPizpLxw
Name (1S,6S)-2-Acetoxy-9-deuteriobicyclo[4.4.0]dec-2-ene
Comments Less than 3 mono-isotopic peaks
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Formula C12H17DO2
InChI InChI=1S/C12H18O2/c1-9(13)14-12-8-4-6-10-5-2-3-7-11(10)12/h8,10-11H,2-7H2,1H3/t10-,11-/m0/s1/i3D/t3?,10-,11-
InChIKey VZVJQGFRRBDHDE-GNZNFKPISA-N
Molecular Weight 195.280 g/mol
SMILES C=1([C@]2(CC([D])CC[C@@]2([H])CCC1)[H])OC(=O)C
SPLASH splash10-0udi-0900000000-3f68b3ef903145e9a3e0
Source of Spectrum KC-0-971-5
Synonyms cis-2-Acetoxy-9-deuteriobicyclo[4.4.0]dec-2-ene
Wiley ID 821097