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DL-5-(1,2-Dithiolan-3-yl)valeramide(3206-73-3) 13C NMR
Product NameDL-5-(1,2-Dithiolan-3-yl)valeramide
CAS3206-73-3
Molecular FormulaC8H15NOS2
Molecular Weight205.34
InChIInChI=1S/C8H15NOS2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H2,9,10)
InChIKey FCCDDURTIIUXBY-UHFFFAOYSA-N
SmilesC(N)(=O)CCCCC1CCSS1
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Assign. Shift(ppm)
A *1 7.24 B *1 6.70 C 3.607 D *2 3.18 E *2 3.12 F *3 2.415 G 2.038 J *3 1.867 K *4 1.66 L *4 1.55 M 1.500 N 1.348Spectral Code: 1H NMR : 400 MHz in DMSO-d6
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ppm Int. Assign.
174.03 776 1 56.06 1000 2 40.28 766 3 38.01 975 4 34.83 761 5 * 34.08 890 6 * 28.29 835 7 24.78 835 8Spectral Code: 13C NMR : DMSO-d6
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Spectral Code: IR : KBr disc
