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ISOBUTYL-[2-(3-METHYL-TETRAHYDRO-(2H)-1,3-THIAZIN-2-YLIDENE)-CYANOACETATE
SpectraBase Compound ID 9SLYhF98hTp
InChI InChI=1S/C12H18N2O2S/c1-9(2)8-16-12(15)10(7-13)11-14(3)5-4-6-17-11/h9H,4-6,8H2,1-3H3/b11-10-
InChIKey ZHFFXUOXRZKFCU-KHPPLWFESA-N
Mol Weight 254.35 g/mol
Molecular Formula C12H18N2O2S
Exact Mass 254.108899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HQi5FDM2HvN
Name (2Z)-2-cyano-2-(3-methyl-1,3-thiazinan-2-ylidene)acetic acid 2-methylpropyl ester
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Formula C12H18N2O2S
InChI InChI=1S/C12H18N2O2S/c1-9(2)8-16-12(15)10(7-13)11-14(3)5-4-6-17-11/h9H,4-6,8H2,1-3H3/b11-10-
InChIKey ZHFFXUOXRZKFCU-KHPPLWFESA-N
Molecular Weight 254.348 g/mol
SMILES C1N(\C(=C\(C(OCC(C)C)=O)C#N)SCC1)C
SPLASH splash10-0udi-0920000000-abf2b17a7a569f247146
Source of Spectrum Y-34-1623-3
Synonyms (2Z)-2-cyano-2-(3-methyl-1,3-thiazinan-2-ylidene)acetic acid isobutyl ester 2-Methylpropyl (2Z)-2-cyano-2-(3-methyl-1,3-thiazinan-2-ylidene)acetate 2-Methylpropyl (2Z)-2-cyano-2-(3-methyl-1,3-thiazinan-2-ylidene)ethanoate isobutyl (2Z)-2-cyano-2-(3-methyl-1,3-thiazinan-2-ylidene)acetate
Wiley ID 1257397