Dataset

beta Lactose[6]

This dataset contains NMR spectra obtained for the sample containing beta Lactose

Chemical Information

molecular Image

InChI	InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3?,4-,5-,6-,7?,8?,9?,10+,11+,12-/m0/s1
SMILES	OCC1O[C@@H](O[C@H]2C(O)C(O)[C@H](O)O[C@H]2CO)C(O)[C@@H](O)[C@H]1O
InChI Key	GUBGYTABKSRVRQ-NXIVNNIUSA-N
Molecular Formula	C12H22O11
Exact Mass	342.300 g/mol

Data and Resources

beta Lactose[6]HTML

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Metadata Information

Field	Value
DOI	10.57992/nmrxiv.p42.s1318.d5801
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D5801
Version
Author	Peter Spiteller
Maintainer
Language	english
MetadataPublished	2025-08-31T17:42:30.000000Z
Related Molecule

Field	Value
Measurement Technique
Measurement Variables	NMR solvent : acquisition nucleus : NMR spectrum by dimensionality : NMR probe : Temperature : K magnetic field strength : Tesla number of scans : scans nuclear magnetic resonance pulse sequence : Spectral Width : number of data points : points relaxation time measurement : seconds

Data-Source Molecule ID	Data-Source
70671195	PubChem
SCHEMBL12136503	SureChEMBL
The data in this table is sourced from UniChem at EBI.