Spectrum PS075607 for L(+)-Tartaric acid

Rating: (*)★(*)★(*)★( )☆( )☆

Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
150.016
C4H6O6
150.016437912
O=C(O)C(O)C(O)C(=O)O
InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)/t1-,2-/m1/s1
FEWJPZIEWOKRBE-JCYAYHJZSA-N

Mass Spectral Metadata

NameValue
[M-H]-
PS075607
Sawada Y, Matsuda F, and Hirai MY. Plant Science Center, RIKEN
Copyright(C) 2008 Plant Science Center, RIKEN
Sawada et al Widely targeted metabolomics based on large-scale MS/MS data for elucidating metabolite accumulation patterns in plants. Plant Cell Physiol(2009) 50:37-47:doi:10.1093/pcp/pcn183
TQD, Waters
Flow-injection QqQ/MS
ESI
Q
Q
LOW-ENERGY CID
10
Q
CENTROID
MS2
negative
0.3351665428511398
0.4835431092432376
149.06
[M-H]-
341.05788273182685 ppm
0.05083808800000611 Da