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3'-Amino-2'-[2-(diethylamino)ethoxy]butyrophenone, dihydrochloride
SpectraBase Compound ID 7kyIPO77CLP
InChI InChI=1S/C16H26N2O2.2ClH/c1-4-8-15(19)13-9-7-10-14(17)16(13)20-12-11-18(5-2)6-3;;/h7,9-10H,4-6,8,11-12,17H2,1-3H3;2*1H
InChIKey VKCLWQMLBPOVPX-UHFFFAOYSA-N
Mol Weight 351.32 g/mol
Molecular Formula C16H28Cl2N2O2
Exact Mass 350.152784 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID HYIEVDuyOAx
Name 3'-Amino-2'-[2-(diethylamino)ethoxy]butyrophenone, dihydrochloride
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.152783548 u
Formula C16H28Cl2N2O2
InChI InChI=1S/C16H26N2O2.2ClH/c1-4-8-15(19)13-9-7-10-14(17)16(13)20-12-11-18(5-2)6-3;;/h7,9-10H,4-6,8,11-12,17H2,1-3H3;2*1H
InChIKey VKCLWQMLBPOVPX-UHFFFAOYSA-N
Molecular Weight 351.318 g/mol
SMILES NC=1C=CC=C(C1OCCN(CC)CC)C(=O)CCC.Cl.Cl
Spectrum/Structure Validation Score (Raman) 0.880714