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Tricyclo[3.3.1.13,7]decane, 2,4-bis(1,1-dimethylethyl)-, (1.alpha.,2.alpha.,3.beta.,4.beta.,5.alpha.,7.beta.)-
SpectraBase Compound ID 9w4P3veJZnN
InChI InChI=1S/C18H32/c1-17(2,3)15-12-7-11-8-13(10-12)16(14(15)9-11)18(4,5)6/h11-16H,7-10H2,1-6H3/t11-,12+,13-,14+,15-,16-/m1/s1
InChIKey BNVZWVVCBUOCHX-ZTYXSZCMSA-N
Mol Weight 248.5 g/mol
Molecular Formula C18H32
Exact Mass 248.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5BV4hK9LbPI
Name Tricyclo[3.3.1.13,7]decane, 2,4-bis(1,1-dimethylethyl)-, (1.alpha.,2.alpha.,3.beta.,4.beta.,5.alpha.,7.beta.)-
CAS Registry Number 132156-51-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H32
InChI InChI=1S/C18H32/c1-17(2,3)15-12-7-11-8-13(10-12)16(14(15)9-11)18(4,5)6/h11-16H,7-10H2,1-6H3/t11-,12+,13-,14+,15-,16-/m1/s1
InChIKey BNVZWVVCBUOCHX-ZTYXSZCMSA-N
Molecular Weight 248.454 g/mol
SMILES [C@]12([C@@]([C@@]3([H])C[C@](C2)(C[C@@]([C@]1(C(C)(C)C)[H])(C3)[H])[H])(C(C)(C)C)[H])[H]
SPLASH splash10-000f-2900000000-3212323d809fc8a7b96a
Source of Spectrum J-56-1712-22
Synonyms (1R,2R,4R,5R)-2,4-ditert-butyltricyclo[3.3.1.1(3,7)]decane 2(a),4(E)-di-t-butyladamantane
Wiley ID 1251847