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1H-Tetrazol-5-amine, N-methyl-1-[2-O-[(4-methylphenoxy)thioxomethyl]-3,5-O-[1,1,3,3-tetrakis(1-methylethyl)-1,3-disiloxanediyl]-.beta.-D-ribofuranosyl]-
SpectraBase Compound ID IybXWURqFLo
InChI InChI=1S/C27H45N5O6SSi2/c1-16(2)40(17(3)4)33-15-22-23(37-41(38-40,18(5)6)19(7)8)24(25(35-22)32-26(28-10)29-30-31-32)36-27(39)34-21-13-11-20(9)12-14-21/h11-14,16-19,22-25H,15H2,1-10H3,(H,28,29,31)/t22-,23-,24-,25-/m1/s1
InChIKey CBSXVJORNXZFHP-ZGFBMJKBSA-N
Mol Weight 623.9 g/mol
Molecular Formula C27H45N5O6SSi2
Exact Mass 623.262908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C8z4Q8mWfKw
Name 1H-Tetrazol-5-amine, N-methyl-1-[2-O-[(4-methylphenoxy)thioxomethyl]-3,5-O-[1,1,3,3-tetrakis(1-methylethyl)-1,3-disiloxanediyl]-.beta.-D-ribofuranosyl]-
CAS Registry Number 112105-20-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H45N5O6SSi2
InChI InChI=1S/C27H45N5O6SSi2/c1-16(2)40(17(3)4)33-15-22-23(37-41(38-40,18(5)6)19(7)8)24(25(35-22)32-26(28-10)29-30-31-32)36-27(39)34-21-13-11-20(9)12-14-21/h11-14,16-19,22-25H,15H2,1-10H3,(H,28,29,31)/t22-,23-,24-,25-/m1/s1
InChIKey CBSXVJORNXZFHP-ZGFBMJKBSA-N
Molecular Weight 623.916 g/mol
SMILES N(c1[n]([C@]2([C@@]([C@@]3(O[Si](O[Si](OC[C@]3(O2)[H])(C(C)C)C(C)C)(C(C)C)C(C)C)[H])(OC(=S)Oc2ccc(cc2)C)[H])[H])nnn1)C
SPLASH splash10-00di-0000940000-9b9738d0f8b1dc02611e
Source of Spectrum AH-117-1451-9
Synonyms 6H-Furo[3,2-f]-1,3,5,2,4-trioxadisilocin, 1H-tetrazol-5-amine deriv. 1-[2'-O-(4-methylphenoxythiocarbonyl)-3',5'-O-(tetraisopropyl-disiloxane-1,3-diyl)-.beta.-D-ribofuranosyl]-5-(methylamino)-tetrazole O-{(6aR,8R,9R,9aR)-2,2,4,4-tetraisopropyl-8-[5-(methylamino)-1H-tetraazol-1-yl]tetrahydro-6H-furo[3,2-f][1,3,5,2,4]trioxadisilocin-9-yl} O-(4-methylphenyl) thiocarbonate
Wiley ID 1411713