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3-Chloro-4'-methoxy-tetra-deuterobiphenyl
SpectraBase Compound ID mFkHp49cE7
InChI InChI=1S/C13H11ClO/c1-15-13-7-5-10(6-8-13)11-3-2-4-12(14)9-11/h2-9H,1H3/i5D,6D,7D,8D
InChIKey BTZLFJNPDUAPSX-KDWZCNHSSA-N
Mol Weight 222.71 g/mol
Molecular Formula C13H72D4ClO
Exact Mass 222.07495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7P5t7lvLsMc
Name 3-Chloro-4'-methoxy-tetra-deuterobiphenyl
Comments Less than 3 mono-isotopic peaks
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Formula C13H7D4ClO
InChI InChI=1S/C13H11ClO/c1-15-13-7-5-10(6-8-13)11-3-2-4-12(14)9-11/h2-9H,1H3/i5D,6D,7D,8D
InChIKey BTZLFJNPDUAPSX-KDWZCNHSSA-N
Molecular Weight 222.707 g/mol
SMILES c1(-c2c(c([2D])c(c(c2[2D])[2D])OC)[2D])cc(Cl)ccc1
SPLASH splash10-0udi-0090000000-b9843886c86e01d3fbb2
Source of Spectrum KO-7-16-2
Wiley ID 1217655