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5-Hydroxy-6-[N-(2-chloroethyl)aminomethyl]naphthalene-1,8-carbolacetone hydrochloride
SpectraBase Compound ID Blpxdz5PwMG
InChI InChI=1S/C14H12ClNO3.ClH/c15-4-5-16-7-8-6-11-12-9(13(8)17)2-1-3-10(12)14(18)19-11;/h1-3,6,16-17H,4-5,7H2;1H
InChIKey NQEXDPOZTCMWLG-UHFFFAOYSA-N
Mol Weight 314.17 g/mol
Molecular Formula C14H13Cl2NO3
Exact Mass 313.027249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Je7sOFd0i8d
Name 5-Hydroxy-6-[N-(2-chloroethyl)aminomethyl]naphthalene-1,8-carbolacetone hydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13Cl2NO3
InChI InChI=1S/C14H12ClNO3.ClH/c15-4-5-16-7-8-6-11-12-9(13(8)17)2-1-3-10(12)14(18)19-11;/h1-3,6,16-17H,4-5,7H2;1H
InChIKey NQEXDPOZTCMWLG-UHFFFAOYSA-N
Molecular Weight 314.168 g/mol
SMILES Cl.N(Cc1cc2OC(c3c2c(c1O)ccc3)=O)CCCl
SPLASH splash10-0002-0900000000-72161d2919d06211cd74
Source of Spectrum E1-39-494-2
Wiley ID 1518775