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D-Arabino-hex-1-enitol, 1,2-dideoxy-3,4,5-tris-o-(phenylmethyl)-

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D-Arabino-hex-1-enitol, 1,2-dideoxy-3,4,5-tris-o-(phenylmethyl)-
SpectraBase Compound ID 4fWOIgNiXrL
InChI InChI=1S/C27H30O4/c1-2-25(29-19-22-12-6-3-7-13-22)27(31-21-24-16-10-5-11-17-24)26(18-28)30-20-23-14-8-4-9-15-23/h2-17,25-28H,1,18-21H2
InChIKey NTOSGFLXZNOARL-UHFFFAOYSA-N
Mol Weight 418.53 g/mol
Molecular Formula C27H30O4
Exact Mass 418.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2OlWYen6RVn
Name D-Arabino-hex-1-enitol, 1,2-dideoxy-3,4,5-tris-o-(phenylmethyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.214409442 u
Formula C27H30O4
InChI InChI=1S/C27H30O4/c1-2-25(29-19-22-12-6-3-7-13-22)27(31-21-24-16-10-5-11-17-24)26(18-28)30-20-23-14-8-4-9-15-23/h2-17,25-28H,1,18-21H2
InChIKey NTOSGFLXZNOARL-UHFFFAOYSA-N
Molecular Weight 418.533 g/mol
SMILES C(OCC=1C=CC=CC1)(C(OCC=1C=CC=CC1)CO)C(OCC1=CC=CC=C1)C=C