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3-isopropyl-6(E)-(bromoethylidene)tetrahydro-2-pyranone
SpectraBase Compound ID FR4UbtvDn3B
InChI InChI=1S/C10H15BrO2/c1-7(2)9-4-3-8(5-6-11)13-10(9)12/h5,7,9H,3-4,6H2,1-2H3/b8-5+
InChIKey PYCCCEJKGDZFSH-VMPITWQZSA-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 CtrKv8LhND6
Name 3-isopropyl-6(E)-(bromoethylidene)tetrahydro-2-pyranone
Alternate Name(s) (6E)-6-(2-bromoethylidene)-3-isopropyltetrahydro-2H-pyran-2-one
CAS Registry Number 136358-17-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15BrO2
InChI InChI=1S/C10H15BrO2/c1-7(2)9-4-3-8(5-6-11)13-10(9)12/h5,7,9H,3-4,6H2,1-2H3/b8-5+
InChIKey PYCCCEJKGDZFSH-VMPITWQZSA-N
Molecular Weight 247.132 g/mol
SMILES C1(O\C(=C\CBr)CCC1C(C)C)=O
SPLASH splash10-0002-4690000000-a808478ad78fc5cc286e
Source of Spectrum J-56-6896-4
Wiley ID 1248478