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(E)-Methyl 2-(4-(3,3-diisopropyltriaz-1-en-1-yl)-3-fluorophenyl)-2,3,3,3-tetrafluoropropanoate
SpectraBase Compound ID B6J79YQlMne
InChI InChI=1S/C16H20F5N3O2/c1-9(2)24(10(3)4)23-22-13-7-6-11(8-12(13)17)15(18,14(25)26-5)16(19,20)21/h6-10H,1-5H3/b23-22+
InChIKey VQXJFXRUWUYWEB-GHVJWSGMSA-N
Mol Weight 381.35 g/mol
Molecular Formula C16H20F5N3O2
Exact Mass 381.147568 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BmmV8tG0dVE
Name (E)-Methyl 2-(4-(3,3-diisopropyltriaz-1-en-1-yl)-3-fluorophenyl)-2,3,3,3-tetrafluoropropanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20F5N3O2
InChI InChI=1S/C16H20F5N3O2/c1-9(2)24(10(3)4)23-22-13-7-6-11(8-12(13)17)15(18,14(25)26-5)16(19,20)21/h6-10H,1-5H3/b23-22+
InChIKey VQXJFXRUWUYWEB-GHVJWSGMSA-N
Literature Reference DOI 10.1021/ol401558z
Molecular Weight 381.347 g/mol
SMILES C(F)(c1cc(c(cc1)\N=N\N(C(C)C)C(C)C)F)(C(F)(F)F)C(=O)OC
SPLASH splash10-0pb9-9071000000-7d238b411a4d1acdeba0
Source of Spectrum A1-15-3468/SMS5-2k
Wiley ID 1748898