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object
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_id
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3EnTNPhNhqb
spectrumID
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3EnTNPhNhqb
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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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5-NITRO-CYCLOSAL-[(2',3',4'-TRI-O-ACETYL-BETA-D-GALACTOPYRANOSIDE)-THYMINE-6']-PHOSPHATE
SpectraBase Compound ID IQOZBCCsUQK
InChI InChI=1S/2C24H26N3O15P/c2*1-11-8-26(24(32)25-22(11)31)23-21(40-14(4)30)20(39-13(3)29)19(38-12(2)28)18(41-23)10-37-43(35)36-9-15-7-16(27(33)34)5-6-17(15)42-43/h2*5-8,18-21,23H,9-10H2,1-4H3,(H,25,31,32)/t2*18-,19+,20+,21-,23-,43?/m11/s1
InChIKey VSDDICCEELLJRY-PMCZAEEOSA-N
Mol Weight 1254.9 g/mol
Molecular Formula C48H52N6O30P2
Exact Mass 1254.220308 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 3EnTNPhNhqb
Name 5-NITRO-CYCLOSAL-[(2',3',4'-TRI-O-ACETYL-BETA-D-GALACTOPYRANOSIDE)-THYMINE-6']-PHOSPHATE
Compound Number 14
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H52N6O30P2
InChI InChI=1S/2C24H26N3O15P/c2*1-11-8-26(24(32)25-22(11)31)23-21(40-14(4)30)20(39-13(3)29)19(38-12(2)28)18(41-23)10-37-43(35)36-9-15-7-16(27(33)34)5-6-17(15)42-43/h2*5-8,18-21,23H,9-10H2,1-4H3,(H,25,31,32)/t2*18-,19+,20+,21-,23-,43?/m11/s1
InChIKey VSDDICCEELLJRY-PMCZAEEOSA-N
Literature Reference Author J.HUCHTING,C.MEIER
Literature Reference Citation EUR.J.ORG.CHEM.,2014,3423(2014)
Literature Reference DOI 10.1002/ejoc.201402047
Molecular Weight 1254.911 g/mol
Solvent CDCl3
Source File Reference UWIR19663
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