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2,2'-(2,5-THIOPHENEDIYL)-BIS-[5-(2-BROMOETHYLIMINO)-4,5-DIHYDRO-4-METHYL-1,3,4-THIADIAZOLE]
SpectraBase Compound ID 6sDR3NEVQDa
InChI InChI=1S/C14H16Br2N6S3/c1-21-13(17-7-5-15)24-11(19-21)9-3-4-10(23-9)12-20-22(2)14(25-12)18-8-6-16/h3-4H,5-8H2,1-2H3/b17-13-,18-14-
InChIKey VFXOXEFGOGUGOK-JTFWXBGUSA-N
Mol Weight 524.31 g/mol
Molecular Formula C14H16Br2N6S3
Exact Mass 521.896534 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B7CvDdP5kLr
Name 2,2'-(2,5-THIOPHENEDIYL)-BIS-[5-(2-BROMOETHYLIMINO)-4,5-DIHYDRO-4-METHYL-1,3,4-THIADIAZOLE]
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16Br2N6S3
InChI InChI=1S/C14H16Br2N6S3/c1-21-13(17-7-5-15)24-11(19-21)9-3-4-10(23-9)12-20-22(2)14(25-12)18-8-6-16/h3-4H,5-8H2,1-2H3/b17-13-,18-14-
InChIKey VFXOXEFGOGUGOK-JTFWXBGUSA-N
Literature Reference Author P.MOLINA,A.TARRAGA,I.DIAZ,A.ESPINOSA,C.GASPAR
Literature Reference Citation HETEROCYCLES,36,1263(1993)
Literature Reference DOI 10.3987/COM-92-6275
Molecular Weight 524.309 g/mol
Solvent CDCl3
Source File Reference UWCP6776