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cis-3-Tert-butylcycloheptanol
SpectraBase Compound ID oiZ2JI5U6z
InChI InChI=1S/C11H22O/c1-11(2,3)9-6-4-5-7-10(12)8-9/h9-10,12H,4-8H2,1-3H3/t9-,10+/m0/s1
InChIKey VDURCKVLVLSNKS-VHSXEESVSA-N
Mol Weight 170.3 g/mol
Molecular Formula C11H22O
Exact Mass 170.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8rxns1Viprq
Name cis-3-Tert-butylcycloheptanol
Alternate Name(s) (1R,3S)-3-tert-butylcycloheptanol
CAS Registry Number 19790-13-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O
InChI InChI=1S/C11H22O/c1-11(2,3)9-6-4-5-7-10(12)8-9/h9-10,12H,4-8H2,1-3H3/t9-,10+/m0/s1
InChIKey VDURCKVLVLSNKS-VHSXEESVSA-N
Molecular Weight 170.296 g/mol
SMILES O[C@]1(C[C@@](C(C)(C)C)(CCCC1)[H])[H]
SPLASH splash10-052b-9100000000-756060265a6bb0537bc6
Source of Spectrum W5-1989-34766-30770
Wiley ID 1167471