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(Z)-ETHYL-3-[(4-BROMOBENZOYL)-(1-PIPERIDYLCARBOTHIOYL)-AMINO]-2-PROPENOATE
SpectraBase Compound ID 8PK2UkcOZVW
InChI InChI=1S/C18H21BrN2O3S/c1-2-24-16(22)10-13-21(18(25)20-11-4-3-5-12-20)17(23)14-6-8-15(19)9-7-14/h6-10,13H,2-5,11-12H2,1H3/b13-10-
InChIKey WKBLJDCBQVENTJ-RAXLEYEMSA-N
Mol Weight 425.34 g/mol
Molecular Formula C18H21BrN2O3S
Exact Mass 424.045627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HSTSmpO1XA4
Name Ethyl 3-{[p-bromobenzoyl(1'-piperidylcarbothioyl)]amino}-2-propenoate
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Formula C18H21BrN2O3S
InChI InChI=1S/C18H21BrN2O3S/c1-2-24-16(22)10-13-21(18(25)20-11-4-3-5-12-20)17(23)14-6-8-15(19)9-7-14/h6-10,13H,2-5,11-12H2,1H3/b13-10-
InChIKey WKBLJDCBQVENTJ-RAXLEYEMSA-N
Molecular Weight 425.341 g/mol
SMILES C(N(C(c1ccc(cc1)Br)=O)\C=C/C(=O)OCC)(N1CCCCC1)=S
SPLASH splash10-001l-6029000000-0bfb23118f8a6d3c5e4c
Source of Spectrum AH-139-1027-4e
Wiley ID 1695768