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Tricyclo[4.2.2.0(2,5)]dec-9-ene-7,8-dicarboxylic anhydride, 3-cyano-
SpectraBase Compound ID MaCM0WZZgh
InChI InChI=1S/C13H11NO3/c14-4-5-3-8-6-1-2-7(9(5)8)11-10(6)12(15)17-13(11)16/h1-2,5-11H,3H2/t5?,6-,7+,8?,9?,10?,11?/m1/s1
InChIKey ZVKGSTWTYVUMKV-WHXILYSCSA-N
Mol Weight 229.23 g/mol
Molecular Formula C13H11NO3
Exact Mass 229.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 17qeizXLAxw
Name Tricyclo[4.2.2.0(2,5)]dec-9-ene-7,8-dicarboxylic anhydride, 3-cyano-
CAS Registry Number 20185-26-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11NO3
InChI InChI=1S/C13H11NO3/c14-4-5-3-8-6-1-2-7(9(5)8)11-10(6)12(15)17-13(11)16/h1-2,5-11H,3H2/t5?,6-,7+,8?,9?,10?,11?/m1/s1
InChIKey ZVKGSTWTYVUMKV-WHXILYSCSA-N
Molecular Weight 229.235 g/mol
SMILES C(#N)C1C2C(C1)[C@@]1(C3C([C@]2(C=C1)[H])C(=O)OC3=O)[H]
SPLASH splash10-0fb9-9400000000-331deeda86764b23b8fa
Source of Spectrum T-68-2754-0
Wiley ID 30695