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Theaspirane B
SpectraBase Compound ID 9DFHXOKDSo0
InChI InChI=1S/C13H22O/c1-10-6-5-8-12(3,4)13(10)9-7-11(2)14-13/h6,11H,5,7-9H2,1-4H3/t11-,13+/m0/s1
InChIKey GYUZHTWCNKINPY-WCQYABFASA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D3xnH9xh17y
Name Theaspirane B
Alternate Name(s) (3S,5S)-3,6,10,10-tetramethyl-4-oxaspiro[4.5]dec-6-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O
InChI InChI=1S/C13H22O/c1-10-6-5-8-12(3,4)13(10)9-7-11(2)14-13/h6,11H,5,7-9H2,1-4H3/t11-,13+/m0/s1
InChIKey GYUZHTWCNKINPY-WCQYABFASA-N
Molecular Weight 194.318 g/mol
SMILES [C@]12(O[C@@](C)(CC2)[H])C(=CCCC1(C)C)C
SPLASH splash10-000i-7900000000-d89875d83d4018ab5ac4
Source of Spectrum PR-1351-0-0
Wiley ID 1191512