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Atom-Mass pairs
Related entries (identical compound): KO001179 KO001178 KO001175 KO001177 KO001176 KZ000231 KZ000232 KZ000233 GLS00013 KNA00041 KNA00042 KNA00043 KO003173 KO003172 KO003176 KO003175 KO003174 KNA00321 KNA00320 KNA00322 PR030010 OUF00312 PR010061 OUF01004
Submission id: KZ000231

Outputs for L-Isoleucine; GC-EI-TOF; MS; 2 TMS; BP:158


Database: Kazusa DNA Research Institute
Entry ID: KZ000231
Synonyms: L-Isoleucine
Total mass: 131.1724
Formula: H13 C6 O2 N1

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS
Instrument: Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies
Instrument type: GC-EI-TOF
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks: 138.0,141.0,144.0,147.0,150.0,154.0,157.0,161.0,164.0,170.0,174.0,183.0,186.0,190.0,199.0,202.0,216.0,219.0,232.0,235.0,242.0,245.0,260.0,
Replicated queried mass peaks: 83.0, 84.0, 86.0, 87.0, 89.0, 90.0, 93.0, 95.0, 96.0, 98.0, 99.0, 101.0, 102.0, 105.0, 108.0, 110.0, 111.0, 113.0, 114.0, 116.0, 117.0, 119.0, 120.0, 124.0, 127.0, 128.0, 130.0, 131.0, 133.0, 134.0, 140.0, 142.0, 143.0, 145.0, 146.0, 148.0, 149.0, 151.0, 158.0, 159.0, 163.0, 171.0, 172.0, 175.0, 176.0, 187.0, 188.0, 191.0, 200.0, 203.0, 217.0, 218.0, 220.0, 233.0, 234.0, 246.0, 247.0, 261.0, 262.0,
Processing time: 0:00:01.124050
Queried mass list: ['82.000', '85.000', '88.000', '91.000', '94.000', '97.000', '100.000', '103.000', '106.000', '109.000', '112.000', '115.000', '118.000', '123.000', '126.000', '129.000', '132.000']



Queried massNum. matched formulasNum. matched fragments
82.0 (link to fragments) 1 1
85.0 (link to fragments) 1 1
88.0 (link to fragments) 1 1
91.0 No match found! No match found!
94.0 (link to fragments) 1 1
97.0 (link to fragments) 1 1
100.0 (link to fragments) 1 1
103.0 (link to fragments) 3 4
106.0 (link to fragments) 3 5
109.0 (link to fragments) 3 5
112.0 (link to fragments) 3 5
115.0 (link to fragments) 3 5
118.0 (link to fragments) 2 3
123.0 (link to fragments) 1 1
126.0 (link to fragments) 1 1
129.0 (link to fragments) 1 1
132.0 (link to fragments) 1 1


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