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(3R,5aS,9aS)-3,6,6,9a-tetramethyl-4,5,5a,7,8,9-hexahydro-3H-benzo[f]oxepin-2-one
SpectraBase Compound ID F4srIamCYDM
InChI InChI=1S/C14H24O2/c1-10-6-7-11-13(2,3)8-5-9-14(11,4)16-12(10)15/h10-11H,5-9H2,1-4H3/t10-,11+,14+/m1/s1
InChIKey OELIEYLPUPSKMP-SUNKGSAMSA-N
Mol Weight 224.34 g/mol
Molecular Formula C14H24O2
Exact Mass 224.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 89BfNNAZhKA
Name 4,4,8,10-Tetramethylcyclohexano[b]oxepan-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O2
InChI InChI=1S/C14H24O2/c1-10-6-7-11-13(2,3)8-5-9-14(11,4)16-12(10)15/h10-11H,5-9H2,1-4H3/t10-,11+,14+/m1/s1
InChIKey OELIEYLPUPSKMP-SUNKGSAMSA-N
Molecular Weight 224.344 g/mol
SMILES [C@@]12(OC([C@@](CC[C@]2(C(C)(C)CCC1)[H])(C)[H])=O)C
SPLASH splash10-0596-6950000000-29c73ecbcfe88f57887a
Source of Spectrum KC-0-459-12
Synonyms (3R,5aS,9aS)-3,6,6,9a-tetramethyl-4,5,5a,7,8,9-hexahydro-3H-benzo[b]oxepin-2-one 4,4,8,9a-tetramethyloctahydro-1-benzoxepin-9(6H)-one
Wiley ID 827460