Dataset

10[2 C]

Chemical Information

InChI	InChI=1S/C29H46O5/c1-23(2)17-10-14-26(6)19(25(17,5)13-12-21(23)30)8-9-20-27(26,7)16-22(31)28(32)15-11-18-24(3,4)33-34-29(18,20)28/h17-20,22,31-32H,8-16H2,1-7H3/t17-,18-,19+,20-,22-,25-,26+,27+,28+,29-/m0/s1
SMILES	CC1(C)OO[C@@]23[C@H]4CC[C@@H]5[C@@]6(C)CCC(=O)C(C)(C)[C@@H]6CC[C@@]5(C)[C@]4(C)C[C@H](O)[C@]2(O)CC[C@@H]13
InChI Key	VNQITJAGOOJWMF-LDHIFEOASA-N

Data and Resources

• 10[2 C]HTML
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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.57992/nmrxiv.p150.s1503.d6604
License URL	https://creativecommons.org/licenses/by-nc/4.0/legalcode
Source	https://nmrxiv.org/D6604
Version
Author
Maintainer
Language	english
MetadataPublished	2025-11-20T10:19:11.000000Z
Related Molecule

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables	NMR solvent : CDCl3 acquisition nucleus : ['13C'] NMR spectrum by dimensionality : 1 NMR probe : 5 mm QNP 1H/13C/31P/19F Z3246/0085 Temperature : 296.5 K magnetic field strength : 7.047958217355808 Tesla number of scans : 5000 scans nuclear magnetic resonance pulse sequence : zgpg30 Spectral Width : 240.022390154251 number of data points : 32768 points relaxation time measurement : 2 seconds

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.