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5H-[1,2,4]Triazolo[5,1-a]isoindole, 2-[(2,4-dichlorophenoxy)methyl]-
SpectraBase Compound ID 8EljGang1yM
InChI InChI=1S/C16H11Cl2N3O/c17-11-5-6-14(13(18)7-11)22-9-15-19-16-12-4-2-1-3-10(12)8-21(16)20-15/h1-7H,8-9H2
InChIKey CVSKSXOWKCRZNU-UHFFFAOYSA-N
Mol Weight 332.19 g/mol
Molecular Formula C16H11Cl2N3O
Exact Mass 331.027917 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EaEqivCO2uh
Name 5H-[1,2,4]Triazolo[5,1-a]isoindole, 2-[(2,4-dichlorophenoxy)methyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11Cl2N3O
InChI InChI=1S/C16H11Cl2N3O/c17-11-5-6-14(13(18)7-11)22-9-15-19-16-12-4-2-1-3-10(12)8-21(16)20-15/h1-7H,8-9H2
InChIKey CVSKSXOWKCRZNU-UHFFFAOYSA-N
Molecular Weight 332.190 g/mol
SMILES c1cc2C[n]3c(nc(n3)COc3c(cc(cc3)Cl)Cl)-c2cc1
SPLASH splash10-00di-3900000000-def7beb76c736ff40043
Source of Spectrum IY-2-4898-0
Synonyms 2-[(2,4-dichlorophenoxy)methyl]-5H-[1,2,4]triazolo[5,1-a]isoindole 2-[[2,4-bis(chloranyl)phenoxy]methyl]-5H-[1,2,4]triazolo[5,1-a]isoindole
Wiley ID 1656963