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1-Acetoxy-4,5,6,7-tetrachlorobenzotriazole-O-18
SpectraBase Compound ID 4RrztIwGGeY
InChI InChI=1S/C8H3Cl4N3O2/c1-2(16)17-15-8-6(12)4(10)3(9)5(11)7(8)13-14-15/h1H3/i16+2
InChIKey GZKKKAKAESQJFF-VPMSBSONSA-N
Mol Weight 316.9 g/mol
Molecular Formula C8H3Cl4N3O18O
Exact Mass 314.902182 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DyUpogi4NVg
Name 1-Acetoxy-4,5,6,7-tetrachlorobenzotriazole-O-18
CAS Registry Number 18346-74-2
Comments Original formula: C8H3Cl4N3O[18O]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H3Cl4N3O2
InChI InChI=1S/C8H3Cl4N3O2/c1-2(16)17-15-8-6(12)4(10)3(9)5(11)7(8)13-14-15/h1H3/i16+2
InChIKey GZKKKAKAESQJFF-VPMSBSONSA-N
Molecular Weight 316.943 g/mol
SMILES c12[n](nnc2c(Cl)c(c(c1Cl)Cl)Cl)OC(=[18O])C
SPLASH splash10-00xr-4493000000-b0b4fe54ab67ce41e1d8
Source of Spectrum J-4-359-2
Wiley ID 1313995