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2-Cyclohexen-1-one, 4-bromo-2,5,6,6-tetramethyl-, cis-
SpectraBase Compound ID HzSursVWHwc
InChI InChI=1S/C10H15BrO/c1-6-5-8(11)7(2)10(3,4)9(6)12/h5,7-8H,1-4H3/t7-,8-/m0/s1
InChIKey BSCUJIFHUVFDKM-YUMQZZPRSA-N
Mol Weight 231.13 g/mol
Molecular Formula C10H15BrO
Exact Mass 230.030628 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vtHM7rKP8c
Name 2-Cyclohexen-1-one, 4-bromo-2,5,6,6-tetramethyl-, cis-
CAS Registry Number 124886-74-4
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Formula C10H15BrO
InChI InChI=1S/C10H15BrO/c1-6-5-8(11)7(2)10(3,4)9(6)12/h5,7-8H,1-4H3/t7-,8-/m0/s1
InChIKey BSCUJIFHUVFDKM-YUMQZZPRSA-N
Molecular Weight 231.133 g/mol
SMILES C1(C(C(C)=C[C@@]([C@@]1(C)[H])(Br)[H])=O)(C)C
SPLASH splash10-0w2c-7900000000-4f28617d831e9a0d9412
Source of Spectrum H-72-1412-21
Synonyms (4S,5R)-4-bromo-2,5,6,6-tetramethyl-2-cyclohexen-1-one cis-4-bromo-2,5,6,6-tetramethylcyclohex-2-en-1-one
Wiley ID 1231317