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4-Isothiocyanato-5-methylcyclohex-4-ene-1,1,2,2-tetracarbonitrile

View entire compound with spectra: 1 MS (GC)

4-Isothiocyanato-5-methylcyclohex-4-ene-1,1,2,2-tetracarbonitrile
SpectraBase Compound ID 7HqvaL6NlG4
InChI InChI=1S/C12H7N5S/c1-9-2-11(4-13,5-14)12(6-15,7-16)3-10(9)17-8-18/h2-3H2,1H3
InChIKey COSQERFRDKGYOF-UHFFFAOYSA-N
Mol Weight 253.28 g/mol
Molecular Formula C12H7N5S
Exact Mass 253.042216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DhoUpeVou
Name 4-Isothiocyanato-5-methylcyclohex-4-ene-1,1,2,2-tetracarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7N5S
InChI InChI=1S/C12H7N5S/c1-9-2-11(4-13,5-14)12(6-15,7-16)3-10(9)17-8-18/h2-3H2,1H3
InChIKey COSQERFRDKGYOF-UHFFFAOYSA-N
Molecular Weight 253.283 g/mol
SMILES C1(C(CC(=C(C1)C)N=C=S)(C#N)C#N)(C#N)C#N
SPLASH splash10-0ufr-3790000000-447268ac3870720915f4
Source of Spectrum C5-2002-1430-16
Wiley ID 1614809