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1-[(3aR,5S,6S,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-1,2,4-triazole

View entire compound with spectra: 1 MS (GC)

1-[(3aR,5S,6S,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-1,2,4-triazole
SpectraBase Compound ID EmNADK7DTYb
InChI InChI=1S/C14H21N3O5/c1-13(2)18-5-8(20-13)10-9(17-7-15-6-16-17)11-12(19-10)22-14(3,4)21-11/h6-12H,5H2,1-4H3/t8-,9+,10-,11-,12-/m1/s1
InChIKey WVZADNLDYATNGO-IYKVGLELSA-N
Mol Weight 311.34 g/mol
Molecular Formula C14H21N3O5
Exact Mass 311.148121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2UKXsSmXRo
Name 1-[(3aR,5S,6S,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-1,2,4-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21N3O5
InChI InChI=1S/C14H21N3O5/c1-13(2)18-5-8(20-13)10-9(17-7-15-6-16-17)11-12(19-10)22-14(3,4)21-11/h6-12H,5H2,1-4H3/t8-,9+,10-,11-,12-/m1/s1
InChIKey WVZADNLDYATNGO-IYKVGLELSA-N
Molecular Weight 311.338 g/mol
SMILES [C@]12([C@]([C@]([C@@]3(OC(C)(C)OC3)[H])([H])O[C@@]1(OC(O2)(C)C)[H])([n]1ncnc1)[H])[H]
SPLASH splash10-0udm-7970000000-80b5d7d6a9fcaa448e00
Source of Spectrum F-55-10521-26
Wiley ID 839004