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6,6,7,7-Tetrahydro-1,2,3,4,5,6,7,8-octadeoxy-10,11:12,13-di-o-isopropylidene-D-manno-tridecitol

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

6,6,7,7-Tetrahydro-1,2,3,4,5,6,7,8-octadeoxy-10,11:12,13-di-o-isopropylidene-D-manno-tridecitol
SpectraBase Compound ID BEM76RAP7dK
InChI InChI=1S/C19H32O5/c1-6-7-8-9-10-11-12-14(20)16-17(24-19(4,5)23-16)15-13-21-18(2,3)22-15/h14-17,20H,6-9,12-13H2,1-5H3/t14-,15-,16-,17-/m1/s1
InChIKey UEAOMDYQPKLJGB-QBPKDAKJSA-N
Mol Weight 340.5 g/mol
Molecular Formula C19H32O5
Exact Mass 340.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4xPZSWQ2eVD
Name 6,6,7,7-Tetrahydro-1,2,3,4,5,6,7,8-octadeoxy-10,11:12,13-di-o-isopropylidene-D-manno-tridecitol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.224974125 u
Formula C19H32O5
InChI InChI=1S/C19H32O5/c1-6-7-8-9-10-11-12-14(20)16-17(24-19(4,5)23-16)15-13-21-18(2,3)22-15/h14-17,20H,6-9,12-13H2,1-5H3/t14-,15-,16-,17-/m1/s1
InChIKey UEAOMDYQPKLJGB-QBPKDAKJSA-N
Molecular Weight 340.460 g/mol
SMILES [C@@]1([C@](OC(O1)(C)C)([C@@](CC#CCCCCC)(O)[H])[H])([C@@]1(OC(C)(C)OC1)[H])[H]