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XHQNQDULAWSPGV-UHFFFAOYSA-N
SpectraBase Compound ID 5vPdpupB57b
InChI InChI=1S/C8H2Cl2N2O2/c9-5-3(1-11)7(13)4(2-12)6(10)8(5)14/h13-14H
InChIKey XHQNQDULAWSPGV-UHFFFAOYSA-N
Mol Weight 229.02 g/mol
Molecular Formula C8H2Cl2N2O2
Exact Mass 227.949333 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5uOMnX50b9p
Name 1,3-Benzenedicarbonitrile, 4,6-dichloro-2,5-dihydroxy-
Alternate Name(s) 4,6-bis(chloranyl)-2,5-bis(oxidanyl)benzene-1,3-dicarbonitrile 4,6-Dichloro-2,5-dihydroxy-benzene-1,3-dicarbonitrile 4,6-Dichloro-2,5-dihydroxy-isophthalonitrile
CAS Registry Number 85979-36-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H2Cl2N2O2
InChI InChI=1S/C8H2Cl2N2O2/c9-5-3(1-11)7(13)4(2-12)6(10)8(5)14/h13-14H
InChIKey XHQNQDULAWSPGV-UHFFFAOYSA-N
Molecular Weight 229.022 g/mol
SMILES Oc1c(c(c(c(c1Cl)C#N)O)C#N)Cl
SPLASH splash10-0059-1290000000-372f157889001bd8a47d
Source of Spectrum K-119-847-12
Wiley ID 1229035