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object
{15}
_id
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2tpn4S22f2v
spectrumID
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2tpn4S22f2v
cost
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specType
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262144
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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compound
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1-[4'-AZIDO-3'-DEOXY-1',6'-DI-O-METHANESULFONYL-BETA-D-PSICOFURANOSYL]-URACIL
SpectraBase Compound ID 6n3ESbeiPfM
InChI InChI=1S/C12H17N5O9S2/c1-27(20,21)24-6-9-8(15-16-13)5-12(26-9,7-25-28(2,22)23)17-4-3-10(18)14-11(17)19/h3-4,8-9H,5-7H2,1-2H3,(H,14,18,19)/t8-,9+,12-/m0/s1
InChIKey KELHHEPQHSITIG-SBMIAAHKSA-N
Mol Weight 439.41 g/mol
Molecular Formula C12H17N5O9S2
Exact Mass 439.046769 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2tpn4S22f2v
Name 1-[4'-AZIDO-3'-DEOXY-1',6'-DI-O-METHANESULFONYL-BETA-D-PSICOFURANOSYL]-URACIL
Compound Number 13
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17N5O9S2
InChI InChI=1S/C12H17N5O9S2/c1-27(20,21)24-6-9-8(15-16-13)5-12(26-9,7-25-28(2,22)23)17-4-3-10(18)14-11(17)19/h3-4,8-9H,5-7H2,1-2H3,(H,14,18,19)/t8-,9+,12-/m0/s1
InChIKey KELHHEPQHSITIG-SBMIAAHKSA-N
Literature Reference Author L.KVAERNO,R.H.WIGHTMAN,J.WENGEL
Literature Reference Citation J.ORG.CHEM.,66,5106(2001)
Literature Reference DOI 10.1021/jo015602v
Molecular Weight 439.415 g/mol
Solvent ACETONE-D6
Source File Reference UWLU27179
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