Dataset

N-Ac-Trp-OEt, 2382-80-1.dept

N-Ac-Trp-OEt, 2382-80-1

Chemical Info

molecular Image
InChI InChI=1S/C15H18N2O3/c1-3-20-15(19)14(17-10(2)18)8-11-9-16-13-7-5-4-6-12(11)13/h4-7,9,14,16H,3,8H2,1-2H3,(H,17,18)/t14-/m0/s1
SMILES CCOC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(C)=O
InChI Key KQGQONPKSKUHHT-AWEZNQCLSA-N
Molecular Formula C15H18N2O3
Exact Mass 274.310 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p12.s78.d456
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D456
Version
Author Mohr J, Porwal D, Chatterjee I, Oestreich M.
Maintainer
Language english
MetadataCreated 2024-04-22T16:48:07.867666
MetadataModified 2024-05-15T09:25:57.826760
MetadataPublished 2022-11-09 09:57:24
Field Value
Measurement Technique distortionless enhancement with polarization transfer
Measurement Variables
NMR solvent : DMSO

acquisition nucleus : 13C

NMR spectrum by dimensionality : 1

NMR probe : 5 mm PATXI 1H/19F/D-13C/15N Z-GRD Z129262/0001

Temperature : 298.002 K

magnetic field strength : 16.441106362506158 Tesla

number of scans : 512 scans

nuclear magnetic resonance pulse sequence : deptsp135

Spectral Width : 231.495397832928

number of data points : 8 points

relaxation time measurement : 1.5 seconds