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5-Ethyl-1-imino-2-methyl-6-thioxo-1,2,8,9,10,10a-hexahydro-5H-pyrimido[5,4-e]pyrrolo[1,2-c]pyrimidine
SpectraBase Compound ID KKlN2ixVqSu
InChI InChI=1S/C12H17N5S/c1-3-16-11-9(10(13)15(2)7-14-11)8-5-4-6-17(8)12(16)18/h7-8,13H,3-6H2,1-2H3
InChIKey FSFXJTBAEPBLMP-UHFFFAOYSA-N
Mol Weight 263.36 g/mol
Molecular Formula C12H17N5S
Exact Mass 263.120467 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7kQz7V6Hx8B
Name 5-Ethyl-1-imino-2-methyl-6-thioxo-1,2,8,9,10,10a-hexahydro-5H-pyrimido[5,4-e]pyrrolo[1,2-c]pyrimidine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17N5S
InChI InChI=1S/C12H17N5S/c1-3-16-11-9(10(13)15(2)7-14-11)8-5-4-6-17(8)12(16)18/h7-8,13H,3-6H2,1-2H3
InChIKey FSFXJTBAEPBLMP-UHFFFAOYSA-N
Molecular Weight 263.363 g/mol
SMILES N=C1C2=C(N(C(N3CCCC23)=S)CC)N=CN1C
SPLASH splash10-03e9-0090000000-a8debce2504fbba906c8
Source of Spectrum F2-44-4580-8a
Wiley ID 1705781