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1-benzyl-5-{[p-(octyloxy)phenyl]sulfonyl}biguanide
SpectraBase Compound ID 9sOMccqvcPS
InChI InChI=1S/C23H33N5O3S/c1-2-3-4-5-6-10-17-31-20-13-15-21(16-14-20)32(29,30)28-23(25)27-22(24)26-18-19-11-8-7-9-12-19/h7-9,11-16H,2-6,10,17-18H2,1H3,(H5,24,25,26,27,28)
InChIKey VYGZSXCJTMEMQO-UHFFFAOYSA-N
Mol Weight 459.6 g/mol
Molecular Formula C23H33N5O3S
Exact Mass 459.230411 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 9vfyk1tE1xY
Name 1-BENZYL-5-{[p-(OCTYLOXY)PHENYL]SULFONYL}BIGUANIDE
Source of Sample A. Colautti, M. Denardo & F. Rubessa, University of Trieste, Trieste, Italy
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H33N5O3S
InChI InChI=1S/C23H33N5O3S/c1-2-3-4-5-6-10-17-31-20-13-15-21(16-14-20)32(29,30)28-23(25)27-22(24)26-18-19-11-8-7-9-12-19/h7-9,11-16H,2-6,10,17-18H2,1H3,(H5,24,25,26,27,28)
InChIKey VYGZSXCJTMEMQO-UHFFFAOYSA-N
Melting Point 152-154C
Molecular Weight 459.609009
Synonyms BIGUANIDE, 1-BENZYL-5-//P-/OCTYL- OXY/PHENYL/SULFONYL/-,
Technique KBr WAFER