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(-)-(S)-2,3-Dimethyl-5-(2-bromoprop-2-yl)cyclohex-2-en-1-one
SpectraBase Compound ID 1KDQVSPTIZA
InChI InChI=1S/C11H17BrO/c1-7-5-9(11(3,4)12)6-10(13)8(7)2/h9H,5-6H2,1-4H3/t9-/m0/s1
InChIKey LYFVCOISRONRFK-VIFPVBQESA-N
Mol Weight 245.16 g/mol
Molecular Formula C11H17BrO
Exact Mass 244.046278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2F1FGY9WQS
Name (-)-(S)-2,3-Dimethyl-5-(2-bromoprop-2-yl)cyclohex-2-en-1-one
Alternate Name(s) (5S)-5-(1-bromo-1-methylethyl)-2,3-dimethyl-2-cyclohexen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17BrO
InChI InChI=1S/C11H17BrO/c1-7-5-9(11(3,4)12)6-10(13)8(7)2/h9H,5-6H2,1-4H3/t9-/m0/s1
InChIKey LYFVCOISRONRFK-VIFPVBQESA-N
Molecular Weight 245.160 g/mol
SMILES C1(=C(C[C@@](CC1=O)(C(Br)(C)C)[H])C)C
SPLASH splash10-05tb-2910000000-a3652a5e5dc6271e0082
Source of Spectrum F-50-8790-18
Wiley ID 1246692