Processed databases
Atom-Mass pairs
Related entries (identical compound):
KNA00124
KNA00121
KNA00123
KNA00122
KNA00519
KNA00522
KNA00521
KNA00520
KZ000226
KZ000225
KO000828
KO000824
KO000825
KO000826
KO000827
Outputs for L-Glutathione (reduced form); LC-ESI-ITFT; MS2; m/z:307.08; NEG
Database: Graduate School of Information Science, NAIST
Entry ID: KNA00521
Synonyms: Glutathione, 5-L-Glutamyl-L-cysteinylglycine, N-(N-gamma-L-Glutamyl-L-cysteinyl)glycine, gamma-L-Glutamyl-L-cysteinyl-glycine, GSH, Reduced glutathione, L-Glutathione (reduced form)
Total mass: 307.3228
Formula: H17 C10 S1 O6 N3
Structure file (with ALATIS unique atom labels)
Experimental information
MS type: MS2Instrument: LTQ Orbitrap XL, Thermo Scientfic
Instrument type: LC-ESI-ITFT
Ionization: ESI
Ionization mode: NEGATIVE
CAMP general report:
Acceptable mass threshold: 2.0158Out of range queried mass peaks:
Replicated queried mass peaks: 126.964508, 129.065903, 144.058365, 144.887985, 160.9814, 168.164948, 178.061081, 180.136841, 185.093628, 186.04837, 211.068451, 243.19873, 255.092987, 263.027802, 273.152283, 289.000427,
Processing time: 0:00:04.103051
Queried mass list: ['125.745', '128.052', '143.062', '145.987', '160.043', '167.024', '171.113', '177.095', '179.112', '184.294', '193.064', '197.280', '210.147', '214.120', '229.254', '232.099', '237.135', '242.127', '254.079', '261.168', '272.139', '288.000']
| Queried mass | Num. matched formulas | Num. matched fragments |
| 125.74498 (link to fragments) | 13 | 63 |
| 128.052338 (link to fragments) | 14 | 71 |
| 143.0625 (link to fragments) | 16 | 101 |
| 145.986572 (link to fragments) | 15 | 94 |
| 160.042572 (link to fragments) | 18 | 101 |
| 167.023895 (link to fragments) | 19 | 129 |
| 171.113388 (link to fragments) | 19 | 113 |
| 177.094879 (link to fragments) | 1 | 1 |
| 179.111725 | No match found! | No match found! |
| 184.29361 | No match found! | No match found! |
| 193.064499 (link to fragments) | 1 | 1 |
| 197.279907 (link to fragments) | 2 | 2 |
| 210.147308 (link to fragments) | 1 | 1 |
| 214.120087 (link to fragments) | 1 | 1 |
| 229.253876 (link to fragments) | 1 | 2 |
| 232.098999 (link to fragments) | 1 | 2 |
| 237.134583 (link to fragments) | 1 | 1 |
| 242.127228 (link to fragments) | 1 | 1 |
| 254.078888 (link to fragments) | 2 | 3 |
| 261.167969 (link to fragments) | 3 | 4 |
| 272.138977 (link to fragments) | 1 | 1 |
| 288.000092 (link to fragments) | 2 | 7 |