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5-Pyrimidinecarbonitrile, 1,2,3,4-tetrahydro-1,3-dimethyl-6-(4-methylphenyl)-2,4-dithioxo-
SpectraBase Compound ID ITlNFNadeZp
InChI InChI=1S/C14H13N3S2/c1-9-4-6-10(7-5-9)12-11(8-15)13(18)17(3)14(19)16(12)2/h4-7H,1-3H3
InChIKey PLMLTZDSHXJQJA-UHFFFAOYSA-N
Mol Weight 287.4 g/mol
Molecular Formula C14H13N3S2
Exact Mass 287.05509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LCSSoksdgrT
Name 5-Pyrimidinecarbonitrile, 1,2,3,4-tetrahydro-1,3-dimethyl-6-(4-methylphenyl)-2,4-dithioxo-
Alternate Name(s) 1,3-Dimethyl-5-cyano-4-(p-tolyl)-2,4-(1H,3H)-pyrimidinedithione 1,3-dimethyl-6-(4-methylphenyl)-2,4-dithioxo-1,2,3,4-tetrahydro-5-pyrimidinecarbonitrile
CAS Registry Number 96497-39-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13N3S2
InChI InChI=1S/C14H13N3S2/c1-9-4-6-10(7-5-9)12-11(8-15)13(18)17(3)14(19)16(12)2/h4-7H,1-3H3
InChIKey PLMLTZDSHXJQJA-UHFFFAOYSA-N
Molecular Weight 287.399 g/mol
SMILES C=1(C(N(C)C(N(C1c1ccc(cc1)C)C)=S)=S)C#N
SPLASH splash10-000i-0190000000-e90d6ed37c6f4afb9605
Source of Spectrum AJ-58-772-7
Wiley ID 1290709