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AM679

View entire compound with spectra: 2 NMR, 3 FTIR, 1 Raman, and 5 MS (GC)

AM679
SpectraBase Compound ID 3bEDTHHb7wE
InChI InChI=1S/C20H20INO/c1-2-3-8-13-22-14-17(15-9-5-7-12-19(15)22)20(23)16-10-4-6-11-18(16)21/h4-7,9-12,14H,2-3,8,13H2,1H3
InChIKey GAJBHYUAJOTAEW-UHFFFAOYSA-N
Mol Weight 417.29 g/mol
Molecular Formula C20H20INO
Exact Mass 417.058959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EszDLjvQtLq
Name AM679
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20INO
InChI InChI=1S/C20H20INO/c1-2-3-8-13-22-14-17(15-9-5-7-12-19(15)22)20(23)16-10-4-6-11-18(16)21/h4-7,9-12,14H,2-3,8,13H2,1H3
InChIKey GAJBHYUAJOTAEW-UHFFFAOYSA-N
Molecular Weight 417.290 g/mol
SMILES c1(c(cccc1)I)C(c1c[n](c2c1cccc2)CCCCC)=O
SPLASH splash10-03di-1690200000-2634001c2e7dc178ef66
Source of Spectrum SWG-33-3891-0
Synonyms (2-Iodophenyl)(1-pentyl-1H-indol-3-yl)-methanone (2-iodophenyl)(1-pentyl-1H-indol-3-yl)methanone
Wiley ID 1810562