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IFALTFCKDDKQIS-LEWJYISDSA-N

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IFALTFCKDDKQIS-LEWJYISDSA-N
SpectraBase Compound ID DaPOC1tMKil
InChI InChI=1S/C21H28N2O3S/c1-17-11-13-19(14-12-17)27(24,25)23-20(18-8-4-2-5-9-18)16-26-21(23)10-6-3-7-15-22/h2,4-5,8-9,11-14,20-21H,3,6-7,10,15-16,22H2,1H3/t20-,21+/m0/s1
InChIKey IFALTFCKDDKQIS-LEWJYISDSA-N
Mol Weight 388.53 g/mol
Molecular Formula C21H28N2O3S
Exact Mass 388.182064 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1jJs02WKnEv
Name IFALTFCKDDKQIS-LEWJYISDSA-N
Compound Number 16FBB
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28N2O3S
InChI InChI=1S/C21H28N2O3S/c1-17-11-13-19(14-12-17)27(24,25)23-20(18-8-4-2-5-9-18)16-26-21(23)10-6-3-7-15-22/h2,4-5,8-9,11-14,20-21H,3,6-7,10,15-16,22H2,1H3/t20-,21+/m0/s1
InChIKey IFALTFCKDDKQIS-LEWJYISDSA-N
Literature Reference Author K.CONDE-FRIEBOES,R.K.SCHJELTVED,J.BREINHOLT
Literature Reference Citation J.ORG.CHEM.,67,8952(2002)
Literature Reference DOI 10.1021/jo026278m
Molecular Weight 388.525 g/mol
Solvent Unknown
Source File Reference UWVN23998