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Acetonitrile, (dihydro-2,2-dimethylfuro[2,3-d]-1,3-dioxol-6(5H)-ylidene)-, [3aR-(3a.alpha.,6Z,6a.alpha.)]-
SpectraBase Compound ID IYC4ZXNVtmf
InChI InChI=1S/C9H11NO3/c1-9(2)12-7-6(3-4-10)5-11-8(7)13-9/h3,7-8H,5H2,1-2H3/b6-3-/t7-,8-/m1/s1
InChIKey WKCXGHDNWLHVLK-NAYHLWOXSA-N
Mol Weight 181.19 g/mol
Molecular Formula C9H11NO3
Exact Mass 181.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XDHyu9LDE
Name Acetonitrile, (dihydro-2,2-dimethylfuro[2,3-d]-1,3-dioxol-6(5H)-ylidene)-, [3aR-(3a.alpha.,6Z,6a.alpha.)]-
Alternate Name(s) Furo[2,3-d]-1,3-dioxole, acetonitrile deriv. (2Z)-((3aR,6aR)-2,2-dimethyldihydrofuro[2,3-d][1,3]dioxol-6(5H)-ylidene)ethanenitrile cis-3-c-cyanomethylene-3-deoxy-1,2-O-isopropylidene .alpha.-D-glycero-tetrofuranose D-glycero-tetrofuranose, 3-(cyanomethylene)-3-deoxy-1,2-O-isopropylidene-, (Z)- .alpha.-
CAS Registry Number 32453-77-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO3
InChI InChI=1S/C9H11NO3/c1-9(2)12-7-6(3-4-10)5-11-8(7)13-9/h3,7-8H,5H2,1-2H3/b6-3-/t7-,8-/m1/s1
InChIKey WKCXGHDNWLHVLK-NAYHLWOXSA-N
Molecular Weight 181.191 g/mol
SMILES [C@@]12(OC(C)(C)O[C@@]2(\C(=C/C#N)CO1)[H])[H]
SPLASH splash10-00r6-9800000000-9cefe02c969e2bd29298
Source of Spectrum KO-3-279-16
Wiley ID 1177337