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4-Butyl-2,6-diamino-3,5-dicyano-4H-thiopyran
SpectraBase Compound ID Bc8xXxhgXFi
InChI InChI=1S/C11H14N4S/c1-2-3-4-7-8(5-12)10(14)16-11(15)9(7)6-13/h7H,2-4,14-15H2,1H3
InChIKey NTSANBCKEXWGDR-UHFFFAOYSA-N
Mol Weight 234.32 g/mol
Molecular Formula C11H14N4S
Exact Mass 234.093918 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4SqQ9QgKTR
Name 4-Butyl-2,6-diamino-3,5-dicyano-4H-thiopyran
Alternate Name(s) 2,6-Diamino-4-butyl-4H-thiopyran-3,5-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14N4S
InChI InChI=1S/C11H14N4S/c1-2-3-4-7-8(5-12)10(14)16-11(15)9(7)6-13/h7H,2-4,14-15H2,1H3
InChIKey NTSANBCKEXWGDR-UHFFFAOYSA-N
Molecular Weight 234.321 g/mol
SMILES NC1=C(C(C(=C(S1)N)C#N)CCCC)C#N
SPLASH splash10-03fu-2910000000-f33504b2e0d0d0a6c6ab
Source of Spectrum QF-45-895-2
Wiley ID 833448