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4,2,8-Ethanylylidene-2H-1-benzopyran, octahydro-3-methyl-, (2.alpha.,3.beta.,4.alpha.,4a.beta.,8.alpha.,8a.beta.,9R*)-
SpectraBase Compound ID 6zh7dJigE2A
InChI InChI=1S/C12H18O/c1-6-9-5-10-8-4-2-3-7(9)12(8)13-11(6)10/h6-12H,2-5H2,1H3/t6-,7+,8-,9+,10+,11+,12-/m1/s1
InChIKey OQZBLPRXJYWPHK-GIFJDQQOSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ERNstF5kCnF
Name 4,2,8-Ethanylylidene-2H-1-benzopyran, octahydro-3-methyl-, (2.alpha.,3.beta.,4.alpha.,4a.beta.,8.alpha.,8a.beta.,9R*)-
Alternate Name(s) 5-Methyl-7-oxatetracyclo[6.4.0.0(2,6).0(4,9)]dodecane 5endo-methyl-7-oxatetracyclo[6.4.0.0(2,6).0(4.9)]dodecane
CAS Registry Number 78596-09-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-6-9-5-10-8-4-2-3-7(9)12(8)13-11(6)10/h6-12H,2-5H2,1H3/t6-,7+,8-,9+,10+,11+,12-/m1/s1
InChIKey OQZBLPRXJYWPHK-GIFJDQQOSA-N
Molecular Weight 178.275 g/mol
SMILES [C@@]12(O[C@]3([C@]4([C@@]2(C[C@@]([C@]1(C)[H])([C@@]3(CCC4)[H])[H])[H])[H])[H])[H]
SPLASH splash10-00fu-6900000000-2e2c629ec63a8516476e
Source of Spectrum H-64-822-0
Wiley ID 1174671