For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Pyrrolo[1,2-c][1,3,2]diazaphosphorine-4-carbonitrile, 1,5,6,7-tetrahydro-1-(methylthio)-3-(1-piperidinyl)-, 1-sulfide
SpectraBase Compound ID 1uzDETRGe99
InChI InChI=1S/C13H19N4PS2/c1-20-18(19)15-13(16-7-3-2-4-8-16)11(10-14)12-6-5-9-17(12)18/h2-9H2,1H3
InChIKey BOHXOKDDSZQENH-UHFFFAOYSA-N
Mol Weight 326.42 g/mol
Molecular Formula C13H19N4PS2
Exact Mass 326.078876 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5lQooIwztJD
Name Pyrrolo[1,2-c][1,3,2]diazaphosphorine-4-carbonitrile, 1,5,6,7-tetrahydro-1-(methylthio)-3-(1-piperidinyl)-, 1-sulfide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19N4PS2
InChI InChI=1S/C13H19N4PS2/c1-20-18(19)15-13(16-7-3-2-4-8-16)11(10-14)12-6-5-9-17(12)18/h2-9H2,1H3
InChIKey BOHXOKDDSZQENH-UHFFFAOYSA-N
Molecular Weight 326.417 g/mol
SMILES C1CCN(C2=NP(N3C(=C2C#N)CCC3)(=S)SC)CC1
SPLASH splash10-004i-4391000000-162d4dd5aa4629b4c7c7
Source of Spectrum IY-1-4342-2
Synonyms 1-(methylthio)-3-(1-piperidinyl)-1-sulfanylidene-6,7-dihydro-5H-pyrrolo[1,2-c][1,3,2]diazaphosphorine-4-carbonitrile 1-Methylsulfanyl-3-(1-piperidyl)-1-thioxo-6,7-dihydro-5H-pyrrolo[1,2-c][1,3,2]diazaphosphinine-4-carbonitrile 1-Methylsulfanyl-3-piperidin-1-yl-1-sulfanylidene-6,7-dihydro-5H-pyrrolo[1,2-c][1,3,2]diazaphosphinine-4-carbonitrile
Wiley ID 1651405