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3-tert-Butyltricyclo[4.2.1.0(2,5)]non-7-ene
SpectraBase Compound ID 2t8V35zstdi
InChI InChI=1S/C13H20/c1-13(2,3)11-7-10-8-4-5-9(6-8)12(10)11/h4-5,8-12H,6-7H2,1-3H3/t8-,9+,10+,11?,12-/m1/s1
InChIKey ZDFYZSBZKSBEGD-URRKRKIDSA-N
Mol Weight 176.3 g/mol
Molecular Formula C13H20
Exact Mass 176.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlFwCgCD1o9
Name 3-tert-Butyltricyclo[4.2.1.0(2,5)]non-7-ene
Comments Less than 3 mono-isotopic peaks
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Formula C13H20
InChI InChI=1S/C13H20/c1-13(2,3)11-7-10-8-4-5-9(6-8)12(10)11/h4-5,8-12H,6-7H2,1-3H3/t8-,9+,10+,11?,12-/m1/s1
InChIKey ZDFYZSBZKSBEGD-URRKRKIDSA-N
Molecular Weight 176.303 g/mol
SMILES [C@@]12([C@@]([C@@]3(C[C@]2(C=C3)[H])[H])(C(C1)C(C)(C)C)[H])[H]
SPLASH splash10-014i-9000000000-91f239184bc570d616a1
Source of Spectrum F-68-2171-23
Wiley ID 1708006