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Cimetidine
SpectraBase Compound ID LZgUo1tlxh1
InChI InChI=1S/C10H16N6S/c1-8-9(16-7-15-8)5-17-4-3-13-10(12-2)14-6-11/h7H,3-5H2,1-2H3,(H,15,16)(H2,12,13,14)
InChIKey AQIXAKUUQRKLND-UHFFFAOYSA-N
Mol Weight 252.34 g/mol
Molecular Formula C10H16N6S
Exact Mass 252.115716 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AfKZbaHjBEH
Name 2-CYANO-1-METHYL-3-{2-{[(5-METHYLIMIDAZOL-4-YL)METHYL]THIO}ETHYL}GUANIDINE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 51481-61-9
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16N6S
InChI InChI=1S/C10H16N6S/c1-8-9(16-7-15-8)5-17-4-3-13-10(12-2)14-6-11/h7H,3-5H2,1-2H3,(H,15,16)(H2,12,13,14)
InChIKey AQIXAKUUQRKLND-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 141C
Molecular Weight 252.34
Solvent DMSO-d6; Reference=TMS; Temperature 297K