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3-(1H-imidazol-5-yl)propyl N-(4-iodophenyl)carbamate
SpectraBase Compound ID 53z3LKLyMjj
InChI InChI=1S/C13H14IN3O2/c14-10-3-5-11(6-4-10)17-13(18)19-7-1-2-12-8-15-9-16-12/h3-6,8-9H,1-2,7H2,(H,15,16)(H,17,18)
InChIKey WJGCASKOKIVMPM-UHFFFAOYSA-N
Mol Weight 371.18 g/mol
Molecular Formula C13H14IN3O2
Exact Mass 371.013072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KmED1BPwaWV
Name 3-(1H-imidazol-5-yl)propyl N-(4-iodophenyl)carbamate
Alternate Name(s) N-(4-iodophenyl)carbamic acid 3-(1H-imidazol-5-yl)propyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14IN3O2
InChI InChI=1S/C13H14IN3O2/c14-10-3-5-11(6-4-10)17-13(18)19-7-1-2-12-8-15-9-16-12/h3-6,8-9H,1-2,7H2,(H,15,16)(H,17,18)
InChIKey WJGCASKOKIVMPM-UHFFFAOYSA-N
Molecular Weight 371.178 g/mol
SMILES N(C(OCCCc1nc[nH]c1)=O)c1ccc(cc1)I
SPLASH splash10-00kb-3490000000-07330798638c1241bda1
Source of Spectrum E1-39-1224-4
Wiley ID 1598729