R-3,C-5-[5-(Dideuterio)methyl]-dimethyl-1,2,3,5,6,7,8-T,8A-octahydroindolizinium-picrate

SpectraBase Compound ID	LcI2wLPwsYD
InChI	InChI=1S/C10H19N.C6H3N3O7/c1-8-4-3-5-10-7-6-9(2)11(8)10;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h8-10H,3-7H2,1-2H3;1-2,10H/i1D2;
InChIKey	QLWPLRJUTYULDM-CUOKRTIESA-N Google Search
Mol Weight	384.39 g/mol
Molecular Formula	C16H202D2N4O7
Exact Mass	384.161403 g/mol

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SpectraBase Spectrum ID	8UQFUQzVJcS
Name	R-3,C-5-[5-(Dideuterio)methyl]-dimethyl-1,2,3,5,6,7,8-T,8A-octahydroindolizinium-picrate
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	384.161402549 u
Formula	C16H20[2D]2N4O7
InChI	InChI=1S/C10H19N.C6H3N3O7/c1-8-4-3-5-10-7-6-9(2)11(8)10;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h8-10H,3-7H2,1-2H3;1-2,10H/i1D2;
InChIKey	QLWPLRJUTYULDM-CUOKRTIESA-N
Molecular Weight	384.385 g/mol
SMILES	C12[NH+](C(CC2)C)C(CCC1)C([2D])[2D].C=1(C(=C(N(=O)=O)C=C(N(=O)=O)C1)[O-])N(=O)=O