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9-Borabicyclo[3.3.1]non-9-yl[(S)-trityl-(R)-cysteinato-O,N]boron
SpectraBase Compound ID 14RGfCnLmvT
InChI InChI=1S/C30H34BNO2S/c33-29-28(32-31(34-29)26-18-10-19-27(31)21-11-20-26)22-35-30(23-12-4-1-5-13-23,24-14-6-2-7-15-24)25-16-8-3-9-17-25/h1-9,12-17,26-28H,10-11,18-22,32H2/t26-,27+,28-,31-/m0/s1
InChIKey RNZOABVQWQAITM-NFAPWKBDSA-N
Mol Weight 483.5 g/mol
Molecular Formula C30H34BNO2S
Exact Mass 483.240331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 73pf4zrNMEC
Name 9-Borabicyclo[3.3.1]non-9-yl[(S)-trityl-(R)-cysteinato-O,N]boron
Alternate Name(s) (4'R)-5'-oxo-4'-{[(triphenylmethyl)sulfanyl]methyl}-9-boraspiro[bicyclo[3.3.1]nonane-9,2'-[1,3,2]oxazaborolidine]-3'-ium-9-uide
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Formula C30H34BNO2S
InChI InChI=1S/C30H34BNO2S/c33-29-28(32-31(34-29)26-18-10-19-27(31)21-11-20-26)22-35-30(23-12-4-1-5-13-23,24-14-6-2-7-15-24)25-16-8-3-9-17-25/h1-9,12-17,26-28H,10-11,18-22,32H2/t26-,27+,28-,31-/m0/s1
InChIKey RNZOABVQWQAITM-NFAPWKBDSA-N
Molecular Weight 483.477 g/mol
SMILES [C@@]1([NH2+][B@@-]2(OC1=O)[C@]1(CCC[C@@]2(CCC1)[H])[H])(CSC(c1ccccc1)(c1ccccc1)c1ccccc1)[H]
SPLASH splash10-0002-0390000000-e5e81a9dc6bc6e940ee3
Source of Spectrum F-54-13319-11
Wiley ID 809623