Debug Info

object
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_id
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7ZvmlSSyjZ2
spectrumID
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7ZvmlSSyjZ2
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specType
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131072
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WMSL3X:136657:1
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analyticalTechnique
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MS (GC)
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Mass Spectrum (GC)
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compound
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2-(3,5-dichloro-4-(trifluoromethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
SpectraBase Compound ID 21WPhRChZ1m
InChI InChI=1S/C13H14BCl2F3O3/c1-11(2)12(3,4)22-14(21-11)7-5-8(15)10(9(16)6-7)20-13(17,18)19/h5-6H,1-4H3
InChIKey TWDZEUVCDKNKBH-UHFFFAOYSA-N
Mol Weight 357.0 g/mol
Molecular Formula C13H14BCl2F3O3
Exact Mass 356.036514 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZvmlSSyjZ2
Name 2-(3,5-dichloro-4-(trifluoromethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14BCl2F3O3
InChI InChI=1S/C13H14BCl2F3O3/c1-11(2)12(3,4)22-14(21-11)7-5-8(15)10(9(16)6-7)20-13(17,18)19/h5-6H,1-4H3
InChIKey TWDZEUVCDKNKBH-UHFFFAOYSA-N
Molecular Weight 356.963 g/mol
SMILES C1(OB(OC1(C)C)c1cc(c(c(c1)Cl)OC(F)(F)F)Cl)(C)C
SPLASH splash10-05fu-0096000000-46930872b6d71aeab7a6
Source of Spectrum A1-17-4256/SM7-1h
Wiley ID 1802253
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