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4-(3-CHLORO-4-FLUOROANILINO)-7-(3-CHLOROPROPOXY)-6-METHOXY-1,2,3-BENZOTRIAZINE

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4-(3-CHLORO-4-FLUOROANILINO)-7-(3-CHLOROPROPOXY)-6-METHOXY-1,2,3-BENZOTRIAZINE
SpectraBase Compound ID LD6LZtp9yoU
InChI InChI=1S/2C17H15Cl2FN4O2/c2*1-25-15-8-11-14(9-16(15)26-6-2-5-18)22-24-23-17(11)21-10-3-4-13(20)12(19)7-10/h2*3-4,7-9H,2,5-6H2,1H3,(H,21,22,23)
InChIKey VYTPHSOKZJRDHX-UHFFFAOYSA-N
Mol Weight 794.47 g/mol
Molecular Formula C34H30Cl4F2N8O4
Exact Mass 792.111219 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G9ciJFo6mwE
Name 4-(3-CHLORO-4-FLUOROANILINO)-7-(3-CHLOROPROPOXY)-6-METHOXY-1,2,3-BENZOTRIAZINE
Compound Number 8M
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H30Cl4F2N8O4
InChI InChI=1S/2C17H15Cl2FN4O2/c2*1-25-15-8-11-14(9-16(15)26-6-2-5-18)22-24-23-17(11)21-10-3-4-13(20)12(19)7-10/h2*3-4,7-9H,2,5-6H2,1H3,(H,21,22,23)
InChIKey VYTPHSOKZJRDHX-UHFFFAOYSA-N
Literature Reference Author J.L.LV,R.WANG,D.LIU,G.GUO,Y.K.JING,L.X.ZHAO
Literature Reference Citation MOLECULES,13,1427(2008)
Literature Reference DOI 10.3390/molecules13061427
Molecular Weight 794.472 g/mol
Sample ID 56743
Solvent DMSO-D6