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(1.alpha.,,2.alpha.,3.alpha.,3a.beta.,4.beta.,7.beta.,7a.beta.)-2,3,3a,4,5,6,7,7a-octahydro-8,8-dimethoxy-4,7-methano-1,2,3-metheno-1H-indene
SpectraBase Compound ID FIgPyXgc8h7
InChI InChI=1S/C13H18O2/c1-14-13(15-2)5-3-4-6(13)8-7(5)9-11-10(8)12(9)11/h5-12H,3-4H2,1-2H3/t5-,6+,7+,8-,9-,10+,11?,12+
InChIKey QTIXPSSELTYBQS-UXAHPXMESA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID p46frWNI4x
Name (1.alpha.,,2.alpha.,3.alpha.,3a.beta.,4.beta.,7.beta.,7a.beta.)-2,3,3a,4,5,6,7,7a-octahydro-8,8-dimethoxy-4,7-methano-1,2,3-metheno-1H-indene
CAS Registry Number 115408-15-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-14-13(15-2)5-3-4-6(13)8-7(5)9-11-10(8)12(9)11/h5-12H,3-4H2,1-2H3/t5-,6+,7+,8-,9-,10+,11?,12+
InChIKey QTIXPSSELTYBQS-UXAHPXMESA-N
Molecular Weight 206.285 g/mol
SMILES [C@]12(C3[C@]2([C@]2([C@@]4(C(OC)(OC)[C@]([C@]2([C@]13[H])[H])(CC4)[H])[H])[H])[H])[H]
SPLASH splash10-0ku6-9800000000-d5ea6e5175f2b9b77730
Source of Spectrum K-121-1670-4
Synonyms (1R,2R,7S,8S)-11,11-dimethoxypentacyclo[6.2.1.0(2,7).0(3,5).0(4,6)]undecane
Wiley ID 1204764