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[OS(NH3)5(4,5-(2-ETA)-7,8-DIHYDRO-2-METHYL-6H-1,3-OXAZOCINE).(HOTF)](OTF)2
SpectraBase Compound ID GSooVBMqPAS
InChI InChI=1S/C7H10NO.3CHF3O3S.5H3N.Os/c1-7-8-5-3-2-4-6-9-7;3*2-1(3,4)8(5,6)7;;;;;;/h8H,2,4,6H2,1H3;3*(H,5,6,7);5*1H3;/q+1;;;;;;;;;+7/p-3/b5-3?,8-7-;;;;;;;;;
InChIKey UQUAEVOIUWESQJ-UCQRCPGHSA-K
Mol Weight 846.74 g/mol
Molecular Formula C10H25F9N6O10OsS3
Exact Mass 848.026538 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8lMUdLM3t8E
Name [OS(NH3)5(4,5-(2-ETA)-7,8-DIHYDRO-2-METHYL-6H-1,3-OXAZOCINE).(HOTF)](OTF)2
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H25F9N6O10OsS3
InChI InChI=1S/C7H10NO.3CHF3O3S.5H3N.Os/c1-7-8-5-3-2-4-6-9-7;3*2-1(3,4)8(5,6)7;;;;;;/h8H,2,4,6H2,1H3;3*(H,5,6,7);5*1H3;/q+1;;;;;;;;;+7/p-3/b5-3?,8-7-;;;;;;;;;
InChIKey UQUAEVOIUWESQJ-UCQRCPGHSA-K
Literature Reference Author H.CHEN,W.D.HARMAN
Literature Reference Citation J.AM.CHEM.SOC.,118,5672(1996)
Literature Reference DOI 10.1021/ja960389j
Molecular Weight 846.708 g/mol
Sample ID 55094
Solvent CD3CN