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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: KO003683

Outputs for Pyridoxal; LC-ESI-QQ; MS2; CE:30 V; [M+H]+


Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003683
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: 57.1, 76.9, 79.1, 80.9, 89.1, 90.7, 92.9, 95.2, 105.0, 107.2, 107.7, 119.0, 122.3, 133.0, 137.8, 140.1, 151.4,
Processing time: 0:00:02.596931
Queried mass list: ['45.100', '53.200', '55.300', '58.300', '64.900', '67.000', '70.900', '73.100', '75.800', '77.900', '80.100', '86.100', '88.700', '91.300', '94.100', '103.900', '106.100', '109.200', '117.300', '121.400', '131.200', '136.100', '139.100', '148.100', '150.200', '167.900']



Queried massNum. matched formulasNum. matched fragments
45.1 No match found! No match found!
53.2 (link to fragments) 3 11
55.3 (link to fragments) 2 5
58.3 (link to fragments) 1 8
64.9 (link to fragments) 4 30
67.0 (link to fragments) 4 22
70.9 (link to fragments) 3 7
73.1 (link to fragments) 2 17
75.8 (link to fragments) 3 33
77.9 (link to fragments) 4 29
80.1 (link to fragments) 4 17
86.1 (link to fragments) 3 16
88.7 (link to fragments) 1 1
91.3 (link to fragments) 2 3
94.1 (link to fragments) 2 3
103.9 No match found! No match found!
106.1 (link to fragments) 2 3
109.2 (link to fragments) 2 3
117.3 (link to fragments) 1 2
121.4 (link to fragments) 2 3
131.2 (link to fragments) 2 4
136.1 (link to fragments) 3 5
139.1 (link to fragments) 3 4
148.1 (link to fragments) 3 6
150.2 (link to fragments) 3 6
167.9 (link to fragments) 1 1


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