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trans-2-Tert-butylcycloheptanol
SpectraBase Compound ID 66evsmbatkY
InChI InChI=1S/C11H22O/c1-11(2,3)9-7-5-4-6-8-10(9)12/h9-10,12H,4-8H2,1-3H3/t9-,10-/m1/s1
InChIKey KUIMTJABMOEUBU-NXEZZACHSA-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 3g7mxRp5BA
Name trans-2-Tert-butylcycloheptanol
Alternate Name(s) (1R,2S)-2-tert-butylcycloheptanol
CAS Registry Number 19790-12-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O
InChI InChI=1S/C11H22O/c1-11(2,3)9-7-5-4-6-8-10(9)12/h9-10,12H,4-8H2,1-3H3/t9-,10-/m1/s1
InChIKey KUIMTJABMOEUBU-NXEZZACHSA-N
Molecular Weight 170.296 g/mol
SMILES O[C@]1([C@](C(C)(C)C)(CCCCC1)[H])[H]
SPLASH splash10-052b-9100000000-d937a35b54f9a1222f25
Source of Spectrum W5-1989-34763-30773
Wiley ID 1167470