Debug Info

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_id
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970KFnTsYyp
spectrumID
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970KFnTsYyp
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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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(1S,2R,4S)-PARA-MENTH-5-ENE-1,2,4-TRIOL-2-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 4dSPXDjB6Ub
InChI InChI=1S/C16H28O8/c1-8(2)16(22)5-4-15(3,21)10(6-16)24-14-13(20)12(19)11(18)9(7-17)23-14/h4-5,8-14,17-22H,6-7H2,1-3H3/t9-,10+,11-,12+,13-,14+,15-,16-/m0/s1
InChIKey RLXDGIYECFLFIF-KTPSRHJKSA-N
Mol Weight 348.39 g/mol
Molecular Formula C16H28O8
Exact Mass 348.178418 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 970KFnTsYyp
Name (1S,2R,4S)-PARA-MENTH-5-ENE-1,2,4-TRIOL-2-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 16
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H28O8
InChI InChI=1S/C16H28O8/c1-8(2)16(22)5-4-15(3,21)10(6-16)24-14-13(20)12(19)11(18)9(7-17)23-14/h4-5,8-14,17-22H,6-7H2,1-3H3/t9-,10+,11-,12+,13-,14+,15-,16-/m0/s1
InChIKey RLXDGIYECFLFIF-KTPSRHJKSA-N
Literature Reference Author T.ISHIKAWA,T.TAKAYANAGI,J.KITAJIMA
Literature Reference Citation CHEM.PHARM.BULL.,50,1471(2002)
Literature Reference DOI 10.1248/cpb.50.1471
Molecular Weight 348.394 g/mol
Solvent C5D5N
Source File Reference UWMS20261
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