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N-(2,3-Butadien-1-yl)-N-(tert-butoxycarbonyl)-2-iodo-4-methoxyaniline
SpectraBase Compound ID KH18sIQbFY4
InChI InChI=1S/C16H20INO3/c1-6-7-10-18(15(19)21-16(2,3)4)14-9-8-12(20-5)11-13(14)17/h7-9,11H,1,10H2,2-5H3
InChIKey RNLHRBFLHIRDFT-UHFFFAOYSA-N
Mol Weight 401.24 g/mol
Molecular Formula C16H20INO3
Exact Mass 401.048789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GMdGejPFVJv
Name N-(2,3-Butadien-1-yl)-N-(tert-butoxycarbonyl)-2-iodo-4-methoxyaniline
Alternate Name(s) tert-Butyl buta-2,3-dien-1-yl(2-iodo-4-methoxyphenyl)carbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20INO3
InChI InChI=1S/C16H20INO3/c1-6-7-10-18(15(19)21-16(2,3)4)14-9-8-12(20-5)11-13(14)17/h7-9,11H,1,10H2,2-5H3
InChIKey RNLHRBFLHIRDFT-UHFFFAOYSA-N
Literature Reference DOI 10.3987/COM-15-13213
Molecular Weight 401.244 g/mol
SMILES c1(N(C(=O)OC(C)(C)C)CC=C=C)c(cc(cc1)OC)I
SPLASH splash10-052b-5179000000-a9910edd34f0049f8326
Source of Spectrum H1-91-1244/SM3-3b
Wiley ID 1804089