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(2R)-2-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-hydroxyacetonitrile

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(2R)-2-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-hydroxyacetonitrile
SpectraBase Compound ID B16bGhvjzMt
InChI InChI=1S/C16H19NO5/c1-16(2)21-14-13(19-9-10-6-4-3-5-7-10)12(11(18)8-17)20-15(14)22-16/h3-7,11-15,18H,9H2,1-2H3/t11-,12-,13+,14-,15-/m1/s1
InChIKey ZEUDKUIOBLGXSR-UXXRCYHCSA-N
Mol Weight 305.33 g/mol
Molecular Formula C16H19NO5
Exact Mass 305.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FeueFkYJrJQ
Name (2R)-2-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-hydroxyacetonitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO5
InChI InChI=1S/C16H19NO5/c1-16(2)21-14-13(19-9-10-6-4-3-5-7-10)12(11(18)8-17)20-15(14)22-16/h3-7,11-15,18H,9H2,1-2H3/t11-,12-,13+,14-,15-/m1/s1
InChIKey ZEUDKUIOBLGXSR-UXXRCYHCSA-N
Molecular Weight 305.330 g/mol
SMILES O[C@@]([C@@]1([C@@]([C@@]2([C@@](OC(O2)(C)C)(O1)[H])[H])(OCc1ccccc1)[H])[H])(C#N)[H]
SPLASH splash10-0006-9000000000-ed0ab08324b359f88e50
Source of Spectrum J-66-5206-16
Synonyms (2R)-2-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-oxidanyl-ethanenitrile (2R)-2-[(3aR,5R,6S,6aR)-6-benzoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-hydroxy-acetonitrile (2R)-2-[(3aR,5R,6S,6aR)-6-benzyloxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-hydroxy-acetonitrile
Wiley ID 1535613