BMRB Metabolomics search

General search

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Experimental entries:
Theoretical entries:

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Search by mass

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Experimental entries:
Theoretical entries:

Tolerance: ± ppm dalton

Isotopic composition:
Average weight
Natural composition (12C 14N)
13C labeled
15N labeled
13C and 15N labeled

Ionization:

Search by structure

Sketch Structure

Chemical identifier:

Since it is the most unique, basing a search on the InChi string is most reliable.

Search by 1D peak list

Search 1D peak lists

Copy and paste a set of peaks


Range (±): ppm

Or upload a peak list:

Search 2D HSQC lists

Copy and paste a set of peaks

Range (±): 1H ppm 13C ppm

Or upload a peak list:

Solvent and field strength

Specify solvent:
D2O
CDCl3
acetone
acetone/D2O
DMSO
methanol
ethanol
benzene

Specify field strength:
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