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4,4-DICHLORO-12-PHENYL-10,11,12-TRIAZAPENTACYCLO[6.5.1.0(2,7).0(3,
SpectraBase Compound ID I4FETsiGOjc
InChI InChI=1S/C17H17Cl2N3/c18-17(19)12-7-9-10-6-11(13(9)14(12)17)16-15(10)20-21-22(16)8-4-2-1-3-5-8/h1-5,9-16H,6-7H2/t9?,10-,11+,12?,13?,14?,15?,16?/m1/s1
InChIKey ODBOJHQQSKXVFH-DKPGVILYSA-N
Mol Weight 334.25 g/mol
Molecular Formula C17H17Cl2N3
Exact Mass 333.079953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cf3MyaCtHUD
Name 4,4-DICHLORO-12-PHENYL-10,11,12-TRIAZAPENTACYCLO[6.5.1.0(2,7).0(3,
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H17Cl2N3
InChI InChI=1S/C17H17Cl2N3/c18-17(19)12-7-9-10-6-11(13(9)14(12)17)16-15(10)20-21-22(16)8-4-2-1-3-5-8/h1-5,9-16H,6-7H2/t9?,10-,11+,12?,13?,14?,15?,16?/m1/s1
InChIKey ODBOJHQQSKXVFH-DKPGVILYSA-N
Molecular Weight 333.0797
SMILES C12N=NN(C1[C@]1(C[C@@]2(C2CC3C(C3C12)(Cl)Cl)[H])[H])c1ccccc1
SPLASH splash10-0a6u-6900000000-70f8166aa5348e83f346
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany