Debug Info

object
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_id
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DDIQUUZwlop
spectrumID
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DDIQUUZwlop
cost
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1
specType
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262144
xnmrNucleus
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WRX:236442:1
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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compound
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(TRANS)-3-BROMO-CYCLOHEXANOL;CONFORMER-2AE
SpectraBase Compound ID BCVR51ks4Jo
InChI InChI=1S/C6H11BrO/c7-5-2-1-3-6(8)4-5/h5-6,8H,1-4H2/t5-,6-/m1/s1
InChIKey CXYNOIDYMJDBLS-PHDIDXHHSA-N
Mol Weight 179.06 g/mol
Molecular Formula C6H11BrO
Exact Mass 177.999328 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DDIQUUZwlop
Name (TRANS)-3-BROMO-CYCLOHEXANOL;CONFORMER-2AE
Compound Number 2
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H11BrO
InChI InChI=1S/C6H11BrO/c7-5-2-1-3-6(8)4-5/h5-6,8H,1-4H2/t5-,6-/m1/s1
InChIKey CXYNOIDYMJDBLS-PHDIDXHHSA-N
Literature Reference Author P.R.D.OLIVEIRA,R.RITTNER
Literature Reference Citation MAGN.RES.CHEM.,46,250(2008)
Literature Reference DOI 10.1002/mrc.2173
Molecular Weight 179.057 g/mol
Solvent CS2:CD2Cl2=9:1
Source File Reference UWIR17493
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