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(3aR,6S,8aR)-6-tert-butyl-2,3,3a,5,6,7,8,8a-octahydro-1H-azulen-4-one
SpectraBase Compound ID BjqEwrf8YPO
InChI InChI=1S/C14H24O/c1-14(2,3)11-8-7-10-5-4-6-12(10)13(15)9-11/h10-12H,4-9H2,1-3H3/t10-,11+,12-/m1/s1
InChIKey BRQWBXRHUTUIOE-GRYCIOLGSA-N
Mol Weight 208.34 g/mol
Molecular Formula C14H24O
Exact Mass 208.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5jn3PuH3JMj
Name (3aR,6S,8aR)-6-tert-butyl-2,3,3a,5,6,7,8,8a-octahydro-1H-azulen-4-one
CAS Registry Number 85283-15-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O
InChI InChI=1S/C14H24O/c1-14(2,3)11-8-7-10-5-4-6-12(10)13(15)9-11/h10-12H,4-9H2,1-3H3/t10-,11+,12-/m1/s1
InChIKey BRQWBXRHUTUIOE-GRYCIOLGSA-N
Molecular Weight 208.345 g/mol
SMILES C1(C[C@@](C(C)(C)C)(CC[C@@]2([C@]1(CCC2)[H])[H])[H])=O
SPLASH splash10-0pwc-9300000000-0b94e39a12eca6e51777
Source of Spectrum GT-1986-69-0
Wiley ID 1207507