Dataset

beta Lactose.hmbc

Chemical Info

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

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p42.s249.d1444
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D1444
Version
Author Peter Spiteller
Maintainer
Language english
MetadataCreated 2024-04-22T16:22:07.668373
MetadataModified 2024-04-22T16:22:07.668379
MetadataPublished 2023-12-24 21:57:47
Field Value
Measurement Technique heteronuclear multiple bond coherence
Measurement Variables
NMR solvent : D2O

acquisition nucleus : 1H , 13C

NMR spectrum by dimensionality : 2

NMR probe : 5 mm CPTCI 1H-13C/15N/2H Z-GRD Z44908/0006

Temperature : 300 K

irradiation frequency : 700.15 MHz , 176.052858 MHz

magnetic field strength : 16.44413958677142 Tesla

number of scans : 4 scans

nuclear magnetic resonance pulse sequence : hmbcetgpl2nd

Spectral Width : 3.98509672558114 , 70.0327731645848

number of data points : 12 points

relaxation time measurement : 2 seconds