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(E)-Methyl 2-(3,5-dichloro-4-(3,3-diisopropyltriaz-1-en-1-yl)phenyl)-2,3,3,3-tetrafluoropropanoate
SpectraBase Compound ID 7Bls2eX8N53
InChI InChI=1S/C16H19Cl2F4N3O2/c1-8(2)25(9(3)4)24-23-13-11(17)6-10(7-12(13)18)15(19,14(26)27-5)16(20,21)22/h6-9H,1-5H3/b24-23+
InChIKey WLHDYBUCEDAHHT-WCWDXBQESA-N
Mol Weight 432.25 g/mol
Molecular Formula C16H19Cl2F4N3O2
Exact Mass 431.079045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID pALJWBdin
Name (E)-Methyl 2-(3,5-dichloro-4-(3,3-diisopropyltriaz-1-en-1-yl)phenyl)-2,3,3,3-tetrafluoropropanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19Cl2F4N3O2
InChI InChI=1S/C16H19Cl2F4N3O2/c1-8(2)25(9(3)4)24-23-13-11(17)6-10(7-12(13)18)15(19,14(26)27-5)16(20,21)22/h6-9H,1-5H3/b24-23+
InChIKey WLHDYBUCEDAHHT-WCWDXBQESA-N
Literature Reference DOI 10.1021/ol401558z
Molecular Weight 432.247 g/mol
SMILES C(c1cc(c(c(c1)Cl)\N=N\N(C(C)C)C(C)C)Cl)(C(F)(F)F)(C(=O)OC)F
SPLASH splash10-0udi-0903200000-b6b3c4c90a488b31ef9e
Source of Spectrum A1-15-3468/SMS6-2n
Wiley ID 1748899