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(Z)-5-Cyano-5,6-dideoxy-1,2-O-isopropylidene-3-O-methyl-5-.alpha.-D-xylo-hepteno-furannurononitrile
SpectraBase Compound ID 48UM4fGWKv2
InChI InChI=1S/C12H14N2O4/c1-12(2)17-10-9(15-3)8(16-11(10)18-12)7(6-14)4-5-13/h4,8-11H,1-3H3/b7-4-/t8-,9+,10?,11+/m1/s1
InChIKey PGAUSOPILQJKFZ-DYHICHFZSA-N
Mol Weight 250.25 g/mol
Molecular Formula C12H14N2O4
Exact Mass 250.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID i26bSxPv6c
Name (Z)-5-Cyano-5,6-dideoxy-1,2-O-isopropylidene-3-O-methyl-5-.alpha.-D-xylo-hepteno-furannurononitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O4
InChI InChI=1S/C12H14N2O4/c1-12(2)17-10-9(15-3)8(16-11(10)18-12)7(6-14)4-5-13/h4,8-11H,1-3H3/b7-4-/t8-,9+,10?,11+/m1/s1
InChIKey PGAUSOPILQJKFZ-DYHICHFZSA-N
Molecular Weight 250.254 g/mol
SMILES C12[C@@](O[C@@]([C@@]2(OC)[H])(\C(C#N)=C/C#N)[H])(OC(O1)(C)C)[H]
SPLASH splash10-053l-6960000000-b6c9d5207c0b0cf7bf47
Source of Spectrum H-64-2701-0
Synonyms (2Z)-2-[(3aS,5R,6S)-6-methoxy-2,2-dimethyl-tetrahydro-2H-furo[2,3-d][1,3]dioxol-5-yl]but-2-enedinitrile
Wiley ID 1252966