John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=JHk9HCObsFO SpectraBase Spectrum ID=2BzrV0yCtrl

(accessed ).
VIOLACENE;(1S,2R,4S,5S,1'E)-1-BROMOMETHYL-1,2,4-TRICHLORO-5-(2'-CHLOROETHENYL)-5-METHYLCYCLOHEXANE
SpectraBase Compound ID JHk9HCObsFO
InChI InChI=1S/C10H13BrCl4/c1-9(2-3-12)5-10(15,6-11)8(14)4-7(9)13/h2-3,7-8H,4-6H2,1H3/b3-2+
InChIKey UJTXKWHTNURSMJ-NSCUHMNNSA-N
Mol Weight 354.9 g/mol
Molecular Formula C10H13BrCl4
Exact Mass 351.895472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2BzrV0yCtrl
Name VIOLACENE;(1S,2R,4S,5S,1'E)-1-BROMOMETHYL-1,2,4-TRICHLORO-5-(2'-CHLOROETHENYL)-5-METHYLCYCLOHEXANE
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H13BrCl4
InChI InChI=1S/C10H13BrCl4/c1-9(2-3-12)5-10(15,6-11)8(14)4-7(9)13/h2-3,7-8H,4-6H2,1H3/b3-2+
InChIKey UJTXKWHTNURSMJ-NSCUHMNNSA-N
Literature Reference Author J.C.COLL,B.W.SKELTON,A.H.WHITE,A.D.WRIGHT
Literature Reference Citation AUSTR.J.CHEM.,41,1743(1988)
Literature Reference DOI 10.1071/ch9881743
Molecular Weight 354.929 g/mol
Solvent Unknown
Source File Reference UWWR1388
SpectraBase Batch ID F78jLZ4tmG2