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2,2'-META-PHENYLENE-BIS-[5-(2-BROMOETHYLIMINO)-4,5-DIHYDRO-4-METHYL-1,3,4-THIADIAZOLE]
SpectraBase Compound ID BMXm5w11KM8
InChI InChI=1S/C16H18Br2N6S2/c1-23-15(19-8-6-17)25-13(21-23)11-4-3-5-12(10-11)14-22-24(2)16(26-14)20-9-7-18/h3-5,10H,6-9H2,1-2H3/b19-15-,20-16-
InChIKey CHYHWAMJXXGDNO-IKBKFCNISA-N
Mol Weight 518.29 g/mol
Molecular Formula C16H18Br2N6S2
Exact Mass 515.940113 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4L2hTM8QOFp
Name 2,2'-m-Phenylenebis[4,5-dihydro-5-(2-bromoethylimino)-4-methyl-1,3,4-thiadiazole}
Alternate Name(s) 2-Bromo-N-((2Z)-5-[3-((5Z)-5-{[(Z)-2-bromoethyl]imino}-4-methyl-4,5-dihydro-1,3,4-thiadiazol-2-yl)phenyl]-3-methyl-1,3,4-thiadiazol-2(3H)-ylidene)ethanamine N-[(Z)-2-bromoethyl]-N-((2Z)-5-[3-((5Z)-5-{[(Z)-2-bromoethyl]imino}-4-methyl-1,3,4-thiadiazol-2(4H)-yl)phenyl]-3-methyl-1,3,4-thiadiazol-2(3H)-ylidene)amine
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Formula C16H18Br2N6S2
InChI InChI=1S/C16H18Br2N6S2/c1-23-15(19-8-6-17)25-13(21-23)11-4-3-5-12(10-11)14-22-24(2)16(26-14)20-9-7-18/h3-5,10H,6-9H2,1-2H3/b19-15-,20-16-
InChIKey CHYHWAMJXXGDNO-IKBKFCNISA-N
Molecular Weight 518.290 g/mol
SMILES CN1\C(SC(=N1)c1cc(C=2S\C(=N/CCBr)N(N2)C)ccc1)=N/CCBr
SPLASH splash10-00or-3950200000-fee38d777248daa008f8
Source of Spectrum H1-36-1272-5
Wiley ID 755148