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1-(2',3',5'-Tris-o-benzyl-.beta.-D-ribofuranosyl)-heptyne

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-(2',3',5'-Tris-o-benzyl-.beta.-D-ribofuranosyl)-heptyne
SpectraBase Compound ID K067yDA2qx7
InChI InChI=1S/C33H38O4/c1-2-3-4-5-15-22-30-32(35-24-28-18-11-7-12-19-28)33(36-25-29-20-13-8-14-21-29)31(37-30)26-34-23-27-16-9-6-10-17-27/h6-14,16-21,30-33H,2-5,23-26H2,1H3/t30-,31+,32-,33+/m0/s1
InChIKey QTXDYHLOCZKWPS-ISSPZXTRSA-N
Mol Weight 498.7 g/mol
Molecular Formula C33H38O4
Exact Mass 498.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6JMPue4unPQ
Name 1-(2',3',5'-Tris-o-benzyl-.beta.-D-ribofuranosyl)-heptyne
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 498.277009700 u
Formula C33H38O4
InChI InChI=1S/C33H38O4/c1-2-3-4-5-15-22-30-32(35-24-28-18-11-7-12-19-28)33(36-25-29-20-13-8-14-21-29)31(37-30)26-34-23-27-16-9-6-10-17-27/h6-14,16-21,30-33H,2-5,23-26H2,1H3/t30-,31+,32-,33+/m0/s1
InChIKey QTXDYHLOCZKWPS-ISSPZXTRSA-N
Molecular Weight 498.663 g/mol
SMILES [C@]1([C@]([C@](C#CCCCCC)(O[C@@]1(COCC=1C=CC=CC1)[H])[H])(OCC=1C=CC=CC1)[H])(OCC=1C=CC=CC1)[H]