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2-(N,N-DieEthylamino)-4-(3-mercaptoeth-1-yl)thio-6-trifluoromethylpyrimidine
SpectraBase Compound ID I76Wc621tfE
InChI InChI=1S/C12H18F3N3S2/c1-3-18(4-2)11-16-9(12(13,14)15)8-10(17-11)20-7-5-6-19/h8,19H,3-7H2,1-2H3
InChIKey WHRDKJIGFFCJQA-UHFFFAOYSA-N
Mol Weight 325.41 g/mol
Molecular Formula C12H18F3N3S2
Exact Mass 325.089424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KON0yiQxdmV
Name 2-(N,N-DieEthylamino)-4-(3-mercaptoeth-1-yl)thio-6-trifluoromethylpyrimidine
Alternate Name(s) 2-(N,N-Diethylamino)-4-(3-Mercapto-propylsulfanyl)-6-trifluoromethylpyrimidine 3-{[2-(diethylamino)-6-(trifluoromethyl)-4-pyrimidinyl]sulfanyl}-1-propanethiol 3-{[2-(diethylamino)-6-(trifluoromethyl)-4-pyrimidinyl]sulfanyl}propyl hydrosulfide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18F3N3S2
InChI InChI=1S/C12H18F3N3S2/c1-3-18(4-2)11-16-9(12(13,14)15)8-10(17-11)20-7-5-6-19/h8,19H,3-7H2,1-2H3
InChIKey WHRDKJIGFFCJQA-UHFFFAOYSA-N
Molecular Weight 325.412 g/mol
SMILES SCCCSc1nc(nc(C(F)(F)F)c1)N(CC)CC
SPLASH splash10-0ufr-0297000000-40a557609c0afd755b6a
Source of Spectrum F-53-17167-12
Wiley ID 804940