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Processed databases
Atom-Mass pairs
Related entries (identical compound): KO001579 KO001578 KO001577 BML82023 BML82022 BML82021 BML82020 KO003685 KO003684 KO003681 KO003683 KO003682 PR100275 KO001580 PR100699 KO001576
Submission id: KO003682

Outputs for Pyridoxal; LC-ESI-QQ; MS2; CE:20 V; [M+H]+


Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003682
Synonyms: Pyridoxal
Total mass: 167.1616
Formula: H9 C8 O3 N1

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 62.9, 68.6, 76.1, 86.9, 93.0, 95.0, 104.9, 106.0, 115.1, 119.2, 123.0, 133.2, 140.1, 151.3,
Processing time: 0:00:02.779506
Queried mass list: ['44.900', '50.300', '58.200', '61.100', '66.800', '72.700', '75.000', '78.100', '80.800', '86.100', '89.000', '91.200', '94.000', '101.100', '104.100', '107.000', '109.200', '113.900', '118.100', '122.300', '132.000', '136.200', '138.300', '148.100', '150.200', '168.200']



Queried massNum. matched formulasNum. matched fragments
44.9 (link to fragments) 1 1
50.3 (link to fragments) 3 22
58.2 (link to fragments) 1 8
61.1 (link to fragments) 2 19
66.8 (link to fragments) 4 22
72.7 (link to fragments) 2 17
75.0 (link to fragments) 3 33
78.1 (link to fragments) 5 26
80.8 (link to fragments) 3 14
86.1 (link to fragments) 3 16
89.0 (link to fragments) 1 1
91.2 (link to fragments) 2 3
94.0 (link to fragments) 2 3
101.1 No match found! No match found!
104.1 (link to fragments) 1 2
107.0 (link to fragments) 2 3
109.2 (link to fragments) 2 3
113.9 (link to fragments) 1 1
118.1 (link to fragments) 2 3
122.3 (link to fragments) 2 3
132.0 (link to fragments) 2 4
136.2 (link to fragments) 3 5
138.3 (link to fragments) 3 4
148.1 (link to fragments) 3 6
150.2 (link to fragments) 3 6
168.2 (link to fragments) 1 1


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