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Methyl L-N.alpha.,N.epison.-Bis(2-methyl-6,6-dioxo-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)lysinate
SpectraBase Compound ID 6aLcopF3MRs
InChI InChI=1S/C21H28N6O6S2/c1-12-23-17-10-34(29,30)8-14(17)19(25-12)22-7-5-4-6-16(21(28)33-3)27-20-15-9-35(31,32)11-18(15)24-13(2)26-20/h16H,4-11H2,1-3H3,(H,22,23,25)(H,24,26,27)/t16-/m0/s1
InChIKey VKNZTLVZCAFZHL-INIZCTEOSA-N
Mol Weight 524.61 g/mol
Molecular Formula C21H28N6O6S2
Exact Mass 524.151175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6EID1HNKTfQ
Name Methyl L-N.alpha.,N.epison.-Bis(2-methyl-6,6-dioxo-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)lysinate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28N6O6S2
InChI InChI=1S/C21H28N6O6S2/c1-12-23-17-10-34(29,30)8-14(17)19(25-12)22-7-5-4-6-16(21(28)33-3)27-20-15-9-35(31,32)11-18(15)24-13(2)26-20/h16H,4-11H2,1-3H3,(H,22,23,25)(H,24,26,27)/t16-/m0/s1
InChIKey VKNZTLVZCAFZHL-INIZCTEOSA-N
Molecular Weight 524.611 g/mol
SMILES N(c1c2CS(Cc2nc(C)n1)(=O)=O)CCCC[C@](Nc1c2c(CS(C2)(=O)=O)nc(n1)C)(C(=O)OC)[H]
SPLASH splash10-053i-7921010000-d098bb307bbaf0d42b25
Source of Spectrum KC-61-1428-4
Wiley ID 1627567