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N-(2,3-Butadien-1-yl)-N-(tert-butoxycarbonyl)-4-chloro-2-iodoaniline
SpectraBase Compound ID 3EXHzbZQQRt
InChI InChI=1S/C15H17ClINO2/c1-5-6-9-18(14(19)20-15(2,3)4)13-8-7-11(16)10-12(13)17/h6-8,10H,1,9H2,2-4H3
InChIKey MGQHXPRMNAVLCV-UHFFFAOYSA-N
Mol Weight 405.66 g/mol
Molecular Formula C15H17ClINO2
Exact Mass 404.999251 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJZbNh1rqMe
Name N-(2,3-Butadien-1-yl)-N-(tert-butoxycarbonyl)-4-chloro-2-iodoaniline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17ClINO2
InChI InChI=1S/C15H17ClINO2/c1-5-6-9-18(14(19)20-15(2,3)4)13-8-7-11(16)10-12(13)17/h6-8,10H,1,9H2,2-4H3
InChIKey MGQHXPRMNAVLCV-UHFFFAOYSA-N
Literature Reference DOI 10.3987/COM-15-13213
Molecular Weight 405.663 g/mol
SMILES c1(N(C(=O)OC(C)(C)C)CC=C=C)c(cc(cc1)Cl)I
SPLASH splash10-0a4j-3229000000-4cd56dd96035a23ba9b4
Source of Spectrum H1-91-1244/SM4-3e
Synonyms tert-Butyl buta-2,3-dien-1-yl(4-chloro-2-iodophenyl)carbamate
Wiley ID 1804091