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Thiocyanic acid, 2-methyl-2-butene-1,4-diyl ester, (Z)-
SpectraBase Compound ID 1zNkfG8n0ey
InChI InChI=1S/C7H8N2S2/c1-7(4-11-6-9)2-3-10-5-8/h2H,3-4H2,1H3/b7-2-
InChIKey IMOUKMJHUNACCO-UQCOIBPSSA-N
Mol Weight 184.27 g/mol
Molecular Formula C7H8N2S2
Exact Mass 184.012891 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJYca31n4SZ
Name Thiocyanic acid, 2-methyl-2-butene-1,4-diyl ester, (Z)-
CAS Registry Number 112127-21-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8N2S2
InChI InChI=1S/C7H8N2S2/c1-7(4-11-6-9)2-3-10-5-8/h2H,3-4H2,1H3/b7-2-
InChIKey IMOUKMJHUNACCO-UQCOIBPSSA-N
Molecular Weight 184.275 g/mol
SMILES C(#N)SC\C(=C/CSC#N)C
SPLASH splash10-02vi-9700000000-137c1336204b062bdb12
Source of Spectrum H-69-1911-9
Synonyms (2Z)-4-(cyanosulfanyl)-2-methyl-2-butenyl thiocyanate (Z)-2-Methyl-2-buten-1,4-diyl-dithiocyanate thiocyanic acid[(Z)-2-methyl-4-thiocyanato-but-2-enyl]ester [(Z)-2-methyl-4-thiocyanato-but-2-enyl]thiocyanate thiocyanic acid [(Z)-2-methyl-4-thiocyanatobut-2-enyl] ester [(Z)-2-methyl-4-thiocyanatobut-2-enyl] thiocyanate [(Z)-2-methyl-4-thiocyanato-but-2-enyl] thiocyanate
Wiley ID 1180083