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3-Benzyl-5-(2-iodoethyl)-4-(iodomethyl)-1,2-oxazole
SpectraBase Compound ID Akh4q5KAbJq
InChI InChI=1S/C13H13I2NO/c14-7-6-13-11(9-15)12(16-17-13)8-10-4-2-1-3-5-10/h1-5H,6-9H2
InChIKey TYGMFRKXQFQDFF-UHFFFAOYSA-N
Mol Weight 453.06 g/mol
Molecular Formula C13H13I2NO
Exact Mass 452.908654 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9uxpkdng4ZR
Name 3-Benzyl-5-(2-iodoethyl)-4-(iodomethyl)-1,2-oxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13I2NO
InChI InChI=1S/C13H13I2NO/c14-7-6-13-11(9-15)12(16-17-13)8-10-4-2-1-3-5-10/h1-5H,6-9H2
InChIKey TYGMFRKXQFQDFF-UHFFFAOYSA-N
Molecular Weight 453.062 g/mol
SMILES c1(noc(c1CI)CCI)Cc1ccccc1
SPLASH splash10-0006-9100000000-d5bd53532587c8a38c91
Source of Spectrum O1-60-1629-7
Synonyms 3-Benzyl-5-(2-iodoethyl)-4-(iodomethyl)isoxazole 5-(2-iodanylethyl)-4-(iodanylmethyl)-3-(phenylmethyl)-1,2-oxazole 5-(2-iodoethyl)-4-(iodomethyl)-3-(phenylmethyl)isoxazole
Wiley ID 1592159