Legacy mzCloud Statistics

Number of compounds: 13,043

Number of spectral trees: 29,707

Raw Filtered Recalibrated
Positive 21,529 21,529 21,529
Negative 8,178 8,178 8,178

Number of spectra: 12,253,915

Raw Filtered Recalibrated
Positive 4,847,342 1,680,588 2,902,988
Negative 1,396,985 486,506 939,506

Number of spectra in positive ESI: 9,430,918

Raw Filtered Recalibrated
MS1 71,884 33,902 47,502
MS2 1,285,474 442,230 797,655
MS3 1,334,088 457,557 750,976
MS4 1,663,326 571,089 956,647
MS5 402,453 143,316 251,634
MS6 75,393 27,179 73,894
MS7 13,178 4,748 20,651
MS8 1,448 530 3,878
MS9 98 37 151

Number of spectra in negative ESI: 2,822,997

Raw Filtered Recalibrated
MS1 27,414 12,498 18,416
MS2 464,955 161,745 282,131
MS3 498,450 171,577 324,646
MS4 311,725 107,703 225,947
MS5 84,514 29,544 71,267
MS6 8,486 2,937 13,510
MS7 1,192 416 3,097
MS8 234 81 483
MS9 15 5 9

Number of precursors: 383,968

Positive Negative
MS2 92,982 35,886
MS3 65,877 30,717
MS4 82,942 25,164
MS5 27,252 8,595
MS6 9,640 1,615
MS7 2,468 326
MS8 417 50
MS9 28 9

Number of peak annotations: 19,930,524

Formulae 17,007,335
Structures 2,923,189

Number of unique optimized structures: 693,891

PM6 level 578,286
BLYP/6-31+G* level 101,761
BLYP/6-311++G** level 13,844

Compound classes

Compounds Trees Spectra
Therapeutics/Prescription Drugs 1,370 2,646 476,185
Drugs of Abuse/Illegal Drugs 1,185 1,922 347,441
Sports Doping Drugs 847 1,503 302,301
Steroids/Vitamins/Hormones 31 67 13,752
Endogenous Metabolites 3,724 5,629 2,526,242
Natural Products/Medicines 1,740 2,299 1,118,278
Natural Toxins 114 165 178,643
Counterfeit Drug (Therapeutic) 71 117 11,398
Extractables/Leachables 550 883 227,648
Pesticides/Herbicides 755 1,295 147,056
Excipients/Additives/Colorants 269 444 162,680
Illegal Additives 60 110 10,898
Personal Care Products/Cosmetics 199 308 73,808
Textile Chemicals/Auxiliary/Dyes 292 440 110,609
Industrial Chemicals 437 738 99,729
Perfluorinated Hydrocarbons 73 128 32,871
Nanomaterials 0 0 0