Processed databases
Atom-Mass pairs
Related entries (identical compound):
BML00777
BML00772
BML80821
BML80820
BML80823
BML80822
BML00747
PB005711
PB005710
CE000048
CE000049
CE000046
CE000047
PB000262
PB000263
PB000261
BML00761
BML00767
PB005707
PB005708
PB005709
CE000050
BML00754
PB000241
Outputs for Biochanin A; LC-ESI-QTOF; MS2; CE 40 ev; [M-H]-
Database: Institute of Biological Chemistry, Washington State University
Entry ID: BML00777
Synonyms: Biochanin A
Total mass: 284.263
Formula: H12 C16 O5
Structure file (with ALATIS unique atom labels)
Experimental information
MS type: MS2Instrument: Agilent 1200 RRLC; Agilent 6520 QTOF
Instrument type: LC-ESI-QTOF
Ionization mode: NEGATIVE
CAMP general report:
Acceptable mass threshold: 2.0158Out of range queried mass peaks:
Replicated queried mass peaks: 104.0543, 105.0356, 117.3468, 128.0644, 132.021, 132.0536, 132.1291, 134.0377, 142.044, 151.0604, 152.0604, 154.0399, 155.0479, 158.0335, 167.0489, 167.087, 170.0397, 179.0495, 180.0563, 183.0434, 184.0521, 195.0447, 195.0913, 196.0519, 198.0349, 200.0396, 211.0398, 211.0857, 211.1319, 211.1746, 211.2794, 211.3926, 211.6107, 212.0913, 223.04, 223.0859, 223.1134, 225.021, 226.0262, 239.0812, 239.1408, 239.1793, 239.2208, 239.2711, 239.4677, 239.8219, 240.0166, 240.0424, 240.0905, 240.1063, 240.2566, 251.0388, 267.0878, 267.1349, 267.1822, 267.2177, 267.2814, 267.3368, 267.3686, 267.5639, 268.0132, 268.036, 268.0929, 268.1307, 268.2772,
Processing time: 0:00:06.354586
Queried mass list: ['104.027', '107.015', '112.648', '117.034', '127.051', '130.041', '132.074', '135.006', '141.032', '143.053', '147.005', '151.002', '153.034', '156.058', '166.040', '168.057', '171.045', '178.041', '182.037', '194.037', '197.024', '199.046', '207.080', '210.032', '212.048', '222.030', '224.049', '239.035', '250.024', '267.030']
| Queried mass | Num. matched formulas | Num. matched fragments |
| 104.027 (link to fragments) | 2 | 241 |
| 107.0154 (link to fragments) | 4 | 180 |
| 112.6482 (link to fragments) | 3 | 289 |
| 117.0342 (link to fragments) | 2 | 296 |
| 127.0511 (link to fragments) | 3 | 95 |
| 130.0408 (link to fragments) | 2 | 72 |
| 132.0744 (link to fragments) | 4 | 79 |
| 135.0065 (link to fragments) | 5 | 49 |
| 141.032 (link to fragments) | 3 | 35 |
| 143.0534 (link to fragments) | 4 | 55 |
| 147.0048 (link to fragments) | 5 | 117 |
| 151.0019 (link to fragments) | 5 | 98 |
| 153.0344 (link to fragments) | 3 | 85 |
| 156.0579 (link to fragments) | 1 | 3 |
| 166.0401 (link to fragments) | 1 | 2 |
| 168.0573 (link to fragments) | 2 | 3 |
| 171.0452 (link to fragments) | 2 | 3 |
| 178.0408 (link to fragments) | 2 | 2 |
| 182.0372 (link to fragments) | 1 | 3 |
| 194.0368 (link to fragments) | 1 | 4 |
| 197.0239 (link to fragments) | 2 | 5 |
| 199.0459 | No match found! | No match found! |
| 207.0801 | No match found! | No match found! |
| 210.0319 | No match found! | No match found! |
| 212.0479 | No match found! | No match found! |
| 222.0298 | No match found! | No match found! |
| 224.0486 | No match found! | No match found! |
| 239.0347 | No match found! | No match found! |
| 250.0245 | No match found! | No match found! |
| 267.0297 (link to fragments) | 2 | 5 |