Debug Info

object
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_id
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4W541dHZJhA
spectrumID
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4W541dHZJhA
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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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3-BETA,21-ALPHA-DIHYDROXY-GAMMACERANE
SpectraBase Compound ID 8nq5tQFNXwf
InChI InChI=1S/C30H52O2/c1-25(2)19-11-17-29(7)21(27(19,5)15-13-23(25)31)9-10-22-28(6)16-14-24(32)26(3,4)20(28)12-18-30(22,29)8/h19-24,31-32H,9-18H2,1-8H3/t19-,20-,21+,22+,23-,24-,27-,28-,29+,30+/m0/s1
InChIKey QIRODTHVSNBDCB-WZKCUUPDSA-N
Mol Weight 444.7 g/mol
Molecular Formula C30H52O2
Exact Mass 444.396731 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 4W541dHZJhA
Name 3-BETA,21-ALPHA-DIHYDROXY-GAMMACERANE
Compound Number 263
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H52O2
InChI InChI=1S/C30H52O2/c1-25(2)19-11-17-29(7)21(27(19,5)15-13-23(25)31)9-10-22-28(6)16-14-24(32)26(3,4)20(28)12-18-30(22,29)8/h19-24,31-32H,9-18H2,1-8H3/t19-,20-,21+,22+,23-,24-,27-,28-,29+,30+/m0/s1
InChIKey QIRODTHVSNBDCB-WZKCUUPDSA-N
Literature Reference Author S.B.MAHATO,A.P.KUNDU
Literature Reference Citation PHYTOCHEM.,37,1517(1994)
Literature Reference DOI 10.1016/S0031-9422(00)89569-2
Molecular Weight 444.742 g/mol
Solvent CDCl3
Source File Reference UWMS5363
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