SpectraBase Compound ID | 7sHToZX8PQE |
---|---|
InChI | InChI=1S/C16H16INO2/c1-20-15-8-2-12(3-9-15)10-11-18-16(19)13-4-6-14(17)7-5-13/h2-9H,10-11H2,1H3,(H,18,19) |
InChIKey | ZTOSECMMXXQBSB-UHFFFAOYSA-N |
Mol Weight | 381.21 g/mol |
Molecular Formula | C16H16INO2 |
Exact Mass | 381.022574 g/mol |
SpectraBase Spectrum ID | GddezcN64KU |
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Name | Benzamide, 4-iodo-N-[2-(4-methoxyphenyl)ethyl]- |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 381.022573757 u |
Formula | C16H16INO2 |
InChI | InChI=1S/C16H16INO2/c1-20-15-8-2-12(3-9-15)10-11-18-16(19)13-4-6-14(17)7-5-13/h2-9H,10-11H2,1H3,(H,18,19) |
InChIKey | ZTOSECMMXXQBSB-UHFFFAOYSA-N |
Molecular Weight | 381.213 g/mol |
SMILES | C(C1=CC=C(C=C1)I)(=O)NCCC1=CC=C(OC)C=C1 |