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5-(Dimethylamino)-2-[methyl(morpholin-4-yl)phosphiorothioyl]-3-pyrrolidin-1-ylpenta-2,4-dienenitrile
SpectraBase Compound ID 4t0WB2MyOvT
InChI InChI=1S/C16H27N4OPS/c1-18(2)9-6-15(19-7-4-5-8-19)16(14-17)22(3,23)20-10-12-21-13-11-20/h6,9H,4-5,7-8,10-13H2,1-3H3/b9-6+,16-15-
InChIKey IOSZUNDGTSTBFC-FHYZWLHTSA-N
Mol Weight 354.45 g/mol
Molecular Formula C16H27N4OPS
Exact Mass 354.16432 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JUXlWq56pxz
Name 5-(Dimethylamino)-2-[methyl(morpholin-4-yl)phosphiorothioyl]-3-pyrrolidin-1-ylpenta-2,4-dienenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H27N4OPS
InChI InChI=1S/C16H27N4OPS/c1-18(2)9-6-15(19-7-4-5-8-19)16(14-17)22(3,23)20-10-12-21-13-11-20/h6,9H,4-5,7-8,10-13H2,1-3H3/b9-6+,16-15-
InChIKey IOSZUNDGTSTBFC-FHYZWLHTSA-N
Molecular Weight 354.453 g/mol
SMILES C1N(P(\C(=C\(\C=C\N(C)C)N2CCCC2)C#N)(=S)C)CCOC1
SPLASH splash10-0ukd-2934000000-a1f6efb8dca669deabb9
Source of Spectrum KC-61-9272-13
Wiley ID 1630599