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Diethyl 2-thiocarbamoyl (1',2'-dihydro-8-acenaphthene)[2',1'-a](1,3,4-oxadiazin-2-ylidene)methylphosphonate
SpectraBase Compound ID 4ZwYHwItL33
InChI InChI=1S/C19H18N3O4PS/c1-3-24-27(23,25-4-2)17(18(20)28)19-22-21-15-12-9-5-7-11-8-6-10-13(14(11)12)16(15)26-19/h5-10H,3-4H2,1-2H3,(H2,20,28)
InChIKey WLQHUOLCFHXYIM-UHFFFAOYSA-N
Mol Weight 415.4 g/mol
Molecular Formula C19H18N3O4PS
Exact Mass 415.075564 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GTHClMUC0UN
Name Diethyl 2-thiocarbamoyl (1',2'-dihydro-8-acenaphthene)[2',1'-a](1,3,4-oxadiazin-2-ylidene)methylphosphonate
Alternate Name(s) Diethyl (1-(9H-acenaphtho[1,2-e][1,3,4]oxadiazin-9-ylidene)-2-amino-2-thioxoethyl)phosphonate
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Formula C19H18N3O4PS
InChI InChI=1S/C19H18N3O4PS/c1-3-24-27(23,25-4-2)17(18(20)28)19-22-21-15-12-9-5-7-11-8-6-10-13(14(11)12)16(15)26-19/h5-10H,3-4H2,1-2H3,(H2,20,28)
InChIKey WLQHUOLCFHXYIM-UHFFFAOYSA-N
Molecular Weight 415.404 g/mol
SMILES NC(C(=C1N=NC2=C(O1)c1c3c(cccc23)ccc1)P(=O)(OCC)OCC)=S
SPLASH splash10-03di-0009200000-6241bdc522d1625480f1
Source of Spectrum HAC-11-202-16
Wiley ID 1783303