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cis-4-Tert-butylcycloheptanol
SpectraBase Compound ID 9CcYxibkjR0
InChI InChI=1S/C11H22O/c1-11(2,3)9-5-4-6-10(12)8-7-9/h9-10,12H,4-8H2,1-3H3/t9-,10+/m0/s1
InChIKey YPWOCRYXPMKZAV-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 B3yAR6rP5I8
Name cis-4-Tert-butylcycloheptanol
Alternate Name(s) (1R,4S)-4-tert-butylcycloheptanol
CAS Registry Number 6221-52-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O
InChI InChI=1S/C11H22O/c1-11(2,3)9-5-4-6-10(12)8-7-9/h9-10,12H,4-8H2,1-3H3/t9-,10+/m0/s1
InChIKey YPWOCRYXPMKZAV-VHSXEESVSA-N
Molecular Weight 170.296 g/mol
SMILES O[C@]1(CC[C@@](C(C)(C)C)(CCC1)[H])[H]
SPLASH splash10-0a4j-9100000000-4ddb56ef48a06e9688ea
Source of Spectrum W5-1989-34767-30769
Wiley ID 1167474