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1,1,4,4-tetrachloro-1a-(4-methoxyphenyl)-3-phenyl-1a,2,3,4-tetrahydro-1H-azirino[1,2-d]benzo[b][1,4]thiazocine
SpectraBase Compound ID 6KPzrG4fNV7
InChI InChI=1S/C24H19Cl4NOS/c1-30-18-13-11-17(12-14-18)22-15-19(16-7-3-2-4-8-16)23(25,26)31-21-10-6-5-9-20(21)29(22)24(22,27)28/h2-14,19H,15H2,1H3
InChIKey TXIAMUJJFUEDKX-UHFFFAOYSA-N
Mol Weight 511.3 g/mol
Molecular Formula C24H19Cl4NOS
Exact Mass 508.994146 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6qjXUzIxiPu
Name 1,1,4,4-tetrachloro-1a-(4-methoxyphenyl)-3-phenyl-1a,2,3,4-tetrahydro-1H-azirino[1,2-d]benzo[b][1,4]thiazocine
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Formula C24H19Cl4NOS
InChI InChI=1S/C24H19Cl4NOS/c1-30-18-13-11-17(12-14-18)22-15-19(16-7-3-2-4-8-16)23(25,26)31-21-10-6-5-9-20(21)29(22)24(22,27)28/h2-14,19H,15H2,1H3
InChIKey TXIAMUJJFUEDKX-UHFFFAOYSA-N
Instrument Name VG-ZAB-HS
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19990730)13_14_1511
Molecular Weight 511.294 g/mol
SMILES C1(Sc2c(N3C(CC1c1ccccc1)(C3(Cl)Cl)c1ccc(cc1)OC)cccc2)(Cl)Cl
SPLASH splash10-0udi-0957100000-5a4b3f8e1b32a70bd1eb
Source of Spectrum RCM-13-1512-2
Wiley ID 1838957