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10-ACETAMIDO-6-BROMO-2-TRIMETHYLSILYLOXY-1,2,3,4,10,11-HEXAHYDRO-13H-1,3-THIAZEPINO-[3,4,5-1,M]-BETA-CARBOLINE
SpectraBase Compound ID H5LuUpsqGDA
InChI InChI=1S/C19H26BrN3O2SSi/c1-12(24)21-16-10-26-11-22-17-6-5-13(20)9-15(17)14-7-8-23(19(16)18(14)22)25-27(2,3)4/h5-6,9,16,19H,7-8,10-11H2,1-4H3,(H,21,24)/t16-,19+/m0/s1
InChIKey IINOSMIRGPUKAP-QFBILLFUSA-N
Mol Weight 468.49 g/mol
Molecular Formula C19H26BrN3O2SSi
Exact Mass 467.069838 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3OlyQZGzsRh
Name 7H-6-Thia-3,7a-diazacyclohepta[jk]fluorene, acetamide deriv.
CAS Registry Number 131653-91-3
Comments Less than 3 mono-isotopic peaks
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Formula C19H26BrN3O2SSi
InChI InChI=1S/C19H26BrN3O2SSi/c1-12(24)21-16-10-26-11-22-17-6-5-13(20)9-15(17)14-7-8-23(19(16)18(14)22)25-27(2,3)4/h5-6,9,16,19H,7-8,10-11H2,1-4H3,(H,21,24)/t16-,19+/m0/s1
InChIKey IINOSMIRGPUKAP-QFBILLFUSA-N
Molecular Weight 468.485 g/mol
SMILES N([C@@]1([C@@]2(c3[n](c4ccc(cc4c3CCN2O[Si](C)(C)C)Br)CSC1)[H])[H])C(=O)C
SPLASH splash10-01i0-0000900000-11c77830012571fde76c
Source of Spectrum I-68-1418-28
Synonyms Acetamide, N-[10-bromo-1,2,3,3a,4,5-hexahydro-3-[(trimethylsilyl)oxy]-7H-6-thia-3,7a-diazacyclohepta[jk]fluoren-4-yl]-, cis-(.+-.)- 1-[1'-acetamido-2'-(trimethylsilylmethylsulfinyl)ethyl]-6-bromo-2-hydroxy-1,2,3,4-tetrahydro-.beta.-carboline 10-Acetamido-6-bromo-2-trimethylsilyloxy-1,2,3,4,10,11-hexahydro 13H-1,3-thiazepino[3,4,5-a,m]-.beta.-carboline N-{(3aR,4R)-10-bromo-3-[(trimethylsilyl)oxy]-1,2,3,3a,4,5-hexahydro-6-thia-3,7a-diazacyclohepta[jk]fluoren-4-yl}acetamide
Wiley ID 1392131