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ISOTHIOCYANIC ACID, p-PHENYLENE ESTER
SpectraBase Compound ID BNMfJPdRZX5
InChI InChI=1S/C8H4N2S2/c11-5-9-7-1-2-8(4-3-7)10-6-12/h1-4H
InChIKey OMWQUXGVXQELIX-UHFFFAOYSA-N
Mol Weight 192.25 g/mol
Molecular Formula C8H4N2S2
Exact Mass 191.98159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L9OPRkw1DiH
Name Benzene, 1,4-diisothiocyanato-
CAS Registry Number 4044-65-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H4N2S2
InChI InChI=1S/C8H4N2S2/c11-5-9-7-1-2-8(4-3-7)10-6-12/h1-4H
InChIKey OMWQUXGVXQELIX-UHFFFAOYSA-N
Molecular Weight 192.254 g/mol
SMILES c1(N=C=S)ccc(cc1)N=C=S
SPLASH splash10-0006-5900000000-0c72dc5859985848c1a1
Source of Spectrum W6-14745-0-0
Synonyms 1,4-Diisothiocyanatobenzene 1,4-Phenylene diisothiocyanate Biscomate Bitoscanat Bitoscanate Bitoscanato Bitoscanatum Isothiocyanic acid, 1,4-phenylenedi- Isothiocyanic acid, p-phenylene ester Jonit p-Phenylene bis(isothiocyanate) p-Phenylene diisothiocyanate Phenylene 1,4-diisothiocyanate Phenylene thiocyanate WM 842 AI3-28258 BRN 2414340 EINECS 223-741-3 HSDB 6435
Wiley ID 90450