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2,2,6,6-Tetramethyl-4-[N(2)-(2'-chloroethyl)-N(2)-nitrosoureido]-1-oxo-perhydropyridinium nitrate
SpectraBase Compound ID 23I0zsAwAXG
InChI InChI=1S/C12H21ClN4O3.NO3/c1-11(2)7-9(8-12(3,4)17(11)20)14-10(18)16(15-19)6-5-13;2-1(3)4/h9H,5-8H2,1-4H3;/q;-1/p+1
InChIKey SGFCQUFURQFMTR-UHFFFAOYSA-O
Mol Weight 367.79 g/mol
Molecular Formula C12H22ClN5O6
Exact Mass 367.125861 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3BUB3lbHNFi
Name 2,2,6,6-Tetramethyl-4-[N(2)-(2'-chloroethyl)-N(2)-nitrosoureido]-1-oxo-perhydropyridinium nitrate
Alternate Name(s) 4-({[1-(2-chloroethyl)-2-oxohydrazino]carbonyl}amino)-2,2,6,6-tetramethyl-1-oxopiperidinium nitrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22ClN5O6
InChI InChI=1S/C12H21ClN4O3.NO3/c1-11(2)7-9(8-12(3,4)17(11)20)14-10(18)16(15-19)6-5-13;2-1(3)4/h9H,5-8H2,1-4H3;/q;-1/p+1
InChIKey SGFCQUFURQFMTR-UHFFFAOYSA-O
Molecular Weight 367.790 g/mol
SMILES N(=O)([O-])=O.N(C(N(N=O)CCCl)=O)C1CC([N+](C(C1)(C)C)=O)(C)C
SPLASH splash10-0a4j-0905000000-5eaa853f75159bcb80f0
Source of Spectrum QF-42-505-12
Wiley ID 832971