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(E)-1-(4-Iodo-2-(ethoxycarbonyldifluoromethyl)phenyl)-3,3-diisopropyltriaz-1-ene
SpectraBase Compound ID FW77cKajfXn
InChI InChI=1S/C16H22F2IN3O2/c1-6-24-15(23)16(17,18)13-9-12(19)7-8-14(13)20-21-22(10(2)3)11(4)5/h7-11H,6H2,1-5H3/b21-20+
InChIKey RATXZHAJRSTYOZ-QZQOTICOSA-N
Mol Weight 453.27 g/mol
Molecular Formula C16H22F2IN3O2
Exact Mass 453.072478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 98DeZlYqpVD
Name (E)-1-(4-Iodo-2-(ethoxycarbonyldifluoromethyl)phenyl)-3,3-diisopropyltriaz-1-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22F2IN3O2
InChI InChI=1S/C16H22F2IN3O2/c1-6-24-15(23)16(17,18)13-9-12(19)7-8-14(13)20-21-22(10(2)3)11(4)5/h7-11H,6H2,1-5H3/b21-20+
InChIKey RATXZHAJRSTYOZ-QZQOTICOSA-N
Literature Reference DOI 10.1021/jo401145g
Molecular Weight 453.272 g/mol
SMILES C(C(F)(c1cc(I)ccc1\N=N\N(C(C)C)C(C)C)F)(OCC)=O
SPLASH splash10-0f6x-9700100000-0a5aaf4aee4b0cf4a65c
Source of Spectrum J-78-7945-6a
Synonyms (E)-ethyl 2-(2-(3,3-diisopropyltriaz-1-en-1-yl)-5-iodophenyl)-2,2-difluoroacetate
Wiley ID 1745705