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5-(2-CYANOETHYL)-TUBERCIDIN

View entire compound with spectra: 1 NMR

5-(2-CYANOETHYL)-TUBERCIDIN
SpectraBase Compound ID J4vov5s7ktV
InChI InChI=1S/C14H17N5O4/c15-3-1-2-7-4-19(13-9(7)12(16)17-6-18-13)14-11(22)10(21)8(5-20)23-14/h4,6,8,10-11,14,20-22H,1-2,5H2,(H2,16,17,18)
InChIKey IRHMPDXIHQGBKR-UHFFFAOYSA-N
Mol Weight 319.32 g/mol
Molecular Formula C14H17N5O4
Exact Mass 319.128054 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EKvGMfXQpa0
Name 5-(2-CYANOETHYL)-TUBERCIDIN
CAS Registry Number 76319-86-3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H17N5O4
InChI InChI=1S/C14H17N5O4/c15-3-1-2-7-4-19(13-9(7)12(16)17-6-18-13)14-11(22)10(21)8(5-20)23-14/h4,6,8,10-11,14,20-22H,1-2,5H2,(H2,16,17,18)
InChIKey IRHMPDXIHQGBKR-UHFFFAOYSA-N
Literature Reference Author D.E.BERGSTROM,A.J.BRATTESANI,M.K.OGAWA,M.J.SCHWEICKERT
Literature Reference Citation J.ORG.CHEM.,46,1423(1981)
Literature Reference DOI 10.1021/jo00320a038
Molecular Weight 319.320 g/mol
Solvent DMSO-D6
Source File Reference UWWR749