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Bicyclo[2.2.1]heptan-2-one, 7-(4-chloro-4-methylpentyl)-1,7-dimethyl-, (1R-syn)-
SpectraBase Compound ID K5W2cHWMFIf
InChI InChI=1S/C15H25ClO/c1-13(2,16)7-5-8-14(3)11-6-9-15(14,4)12(17)10-11/h11H,5-10H2,1-4H3/t11-,14?,15+/m0/s1
InChIKey IIQRYHZBXCDCBD-AXWJTWPOSA-N
Mol Weight 256.82 g/mol
Molecular Formula C15H25ClO
Exact Mass 256.159393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LLuatYXavlr
Name Bicyclo[2.2.1]heptan-2-one, 7-(4-chloro-4-methylpentyl)-1,7-dimethyl-, (1R-syn)-
Comments Computed using HOSE algorithm
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Exact Mass 256.159393124 u
Formula C15H25ClO
InChI InChI=1S/C15H25ClO/c1-13(2,16)7-5-8-14(3)11-6-9-15(14,4)12(17)10-11/h11H,5-10H2,1-4H3/t11-,14?,15+/m0/s1
InChIKey IIQRYHZBXCDCBD-AXWJTWPOSA-N
Molecular Weight 256.817 g/mol
SMILES [C@@]12(C([C@@](CC2)(CC1=O)[H])(CCCC(Cl)(C)C)C)C