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tert-Butyl 1-((1S*,6R*)-1-hydroxy-2,2,6-trimethylcyclohexyl)acetate
SpectraBase Compound ID 2rXSMhtBEIn
InChI InChI=1S/C15H28O3/c1-11-8-7-9-14(5,6)15(11,17)10-12(16)18-13(2,3)4/h11,17H,7-10H2,1-6H3/t11-,15+/m1/s1
InChIKey NDNMIPYGQBGEPR-ABAIWWIYSA-N
Mol Weight 256.39 g/mol
Molecular Formula C15H28O3
Exact Mass 256.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1CNjlrGYI6M
Name tert-Butyl 1-((1S*,6R*)-1-hydroxy-2,2,6-trimethylcyclohexyl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H28O3
InChI InChI=1S/C15H28O3/c1-11-8-7-9-14(5,6)15(11,17)10-12(16)18-13(2,3)4/h11,17H,7-10H2,1-6H3/t11-,15+/m1/s1
InChIKey NDNMIPYGQBGEPR-ABAIWWIYSA-N
Instrument Name Agilent 7890A-5975C or Agilent 6890-5973N
Ionization Type EI
Molecular Weight 256.386 g/mol
SMILES O[C@]1([C@@](CCCC1(C)C)(C)[H])CC(OC(C)(C)C)=O
SPLASH splash10-0f89-9580000000-565918b65d3634bc5ab1
Source of Spectrum WO2017184870A1
Wiley ID 1855498