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(1S,4S,6R)-6-chloro-7-oxabicyclo[2.2.1]hept-2-ene-6-carbonitrile
SpectraBase Compound ID Ll2vG92kHU5
InChI InChI=1S/C7H6ClNO/c8-7(4-9)3-5-1-2-6(7)10-5/h1-2,5-6H,3H2/t5-,6+,7-/m1/s1
InChIKey PPXCEQHKPHIUJU-DSYKOEDSSA-N
Mol Weight 155.58 g/mol
Molecular Formula C7H6ClNO
Exact Mass 155.013792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LOrFJgDJNee
Name 7-Oxabicyclo[2.2.1]hept-5-ene-2-carbonitrile, 2-chloro-, endo-
Alternate Name(s) 2-Chloro-7-oxabicyclo[2.2.1]hept-5-ene-2-carbonitrile 2-Chloro-7-oxabicyclo[2.2.1]hept-5-ene-2-carbonitriles 5-Chloranyl-7-oxabicyclo[2.2.1]hept-2-ene-5-carbonitrile
CAS Registry Number 79901-91-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6ClNO
InChI InChI=1S/C7H6ClNO/c8-7(4-9)3-5-1-2-6(7)10-5/h1-2,5-6H,3H2/t5-,6+,7-/m1/s1
InChIKey PPXCEQHKPHIUJU-DSYKOEDSSA-N
Molecular Weight 155.584 g/mol
SMILES [C@]1([C@]2(O[C@@](C1)(C=C2)[H])[H])(C#N)Cl
SPLASH splash10-014l-8900000000-a0848ffc56ec3be58f46
Source of Spectrum H-65-1704-0
Wiley ID 1152629