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2-Bromo-1-(10,10-dimethyl-3,3-dioxo-3lambda*6*-thia-4-aza-tricyclo[5.2.1.0*1,5*]dec-4-yl)-hexan-1-one
SpectraBase Compound ID 13A8zrnEyzS
InChI InChI=1S/C16H26BrNO3S/c1-4-5-6-12(17)14(19)18-13-9-11-7-8-16(13,15(11,2)3)10-22(18,20)21/h11-13H,4-10H2,1-3H3/t11-,12?,13+,16-/m1/s1
InChIKey YXFQSGUJSCHKSZ-HCYBMXRASA-N
Mol Weight 392.35 g/mol
Molecular Formula C16H26BrNO3S
Exact Mass 391.081678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Cyq5p8a5yN
Name 2-Bromo-1-(10,10-dimethyl-3,3-dioxo-3lambda*6*-thia-4-aza-tricyclo[5.2.1.0*1,5*]dec-4-yl)-hexan-1-one
Alternate Name(s) 4-(2-bromohexanoyl)-10,10-dimethyl-3-thia-4-azatricyclo[5.2.1.0(1,5)]decane 3,3-dioxide N-[(5R)-10,10-Dimethyl-3,3-dioxo-3-thia-4-azatricyclo[5.2.1.0(1,5)]dec-4-yl]-2-bromohexanamide isomer
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Formula C16H26BrNO3S
InChI InChI=1S/C16H26BrNO3S/c1-4-5-6-12(17)14(19)18-13-9-11-7-8-16(13,15(11,2)3)10-22(18,20)21/h11-13H,4-10H2,1-3H3/t11-,12?,13+,16-/m1/s1
InChIKey YXFQSGUJSCHKSZ-HCYBMXRASA-N
Molecular Weight 392.352 g/mol
SMILES [C@]12(N(S(C[C@@]11C([C@@](C2)(CC1)[H])(C)C)(=O)=O)C(=O)C(Br)CCCC)[H]
SPLASH splash10-000i-0911000000-b60d4fba5fe80c74597d
Source of Spectrum F-69-494-1
Wiley ID 1594506