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6-Oxabicyclo[3.2.1]octan-3-one, 2-bromo-2,7,7-trimethyl-, exo-(.+-.)-
SpectraBase Compound ID G3Sz7xMdmU7
InChI InChI=1S/C10H15BrO2/c1-9(2)6-4-7(12)10(3,11)8(5-6)13-9/h6,8H,4-5H2,1-3H3/t6-,8-,10-/m0/s1
InChIKey NCPXYPBGHCSWBX-HKPALBBZSA-N
Mol Weight 247.13 g/mol
Molecular Formula C10H15BrO2
Exact Mass 246.025543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hu21M3bXk7x
Name 6-Oxabicyclo[3.2.1]octan-3-one, 2-bromo-2,7,7-trimethyl-, exo-(.+-.)-
Alternate Name(s) (4R)-4-bromo-4,7,7-trimethyl-6-oxabicyclo[3.2.1]octan-3-one 4.alpha.-bromo-4.beta.,7,7-trimethyl-6-oxabicyclo[3.2.1]octan-3-one
CAS Registry Number 64611-59-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15BrO2
InChI InChI=1S/C10H15BrO2/c1-9(2)6-4-7(12)10(3,11)8(5-6)13-9/h6,8H,4-5H2,1-3H3/t6-,8-,10-/m0/s1
InChIKey NCPXYPBGHCSWBX-HKPALBBZSA-N
Molecular Weight 247.132 g/mol
SMILES [C@@]1([C@]2(OC(C)(C)[C@@](CC1=O)(C2)[H])[H])(Br)C
SPLASH splash10-0002-9460000000-0479dbfdfa670f047ac2
Source of Spectrum J-43-741-0
Wiley ID 1248472