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trans-2-Acetoxy-.deata.(1)-octalin
SpectraBase Compound ID EnQqPs3TNBq
InChI InChI=1S/C12H18O2/c1-9(13)14-12-7-6-10-4-2-3-5-11(10)8-12/h8,10-11H,2-7H2,1H3/t10-,11-/m1/s1
InChIKey FWPJNCADPRUKDT-GHMZBOCLSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRhsrhFAYuC
Name trans-2-Acetoxy-.deata.(1)-octalin
Alternate Name(s) (4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2-naphthalenyl acetate
Comments Less than 3 mono-isotopic peaks
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Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-9(13)14-12-7-6-10-4-2-3-5-11(10)8-12/h8,10-11H,2-7H2,1H3/t10-,11-/m1/s1
InChIKey FWPJNCADPRUKDT-GHMZBOCLSA-N
Molecular Weight 194.274 g/mol
SMILES C1=C(OC(=O)C)CC[C@@]2([C@@]1(CCCC2)[H])[H]
SPLASH splash10-0udi-0900000000-ae8c60e0c4dc0dbf6788
Source of Spectrum KC-0-970-3
Wiley ID 821102