Processed databases
Atom-Mass pairs
Outputs for 4-Methyl-5-thiazoleethanol; LC-ESI-QQ; MS2; CE:50 V; [M+H]+
Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003346
Synonyms: 4-Methyl-5-thiazoleethanol, 4-Methyl-5-(2'-hydroxyethyl)-thiazole, 5-(2-Hydroxyethyl)-4-methylthiazole, 4-Methyl-5-(2-hydroxyethyl)-thiazole
Total mass: 143.2064
Formula: H9 C6 S1 O1 N1
Experimental information
MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: POSITIVE
CAMP general report:
Acceptable mass threshold: 2.0158Out of range queried mass peaks:
Replicated queried mass peaks: 41.1, 44.8, 52.1, 53.0, 55.0, 58.3, 61.0, 66.1, 67.0, 69.3, 71.0, 71.8, 79.3, 81.1, 83.3, 84.0, 86.1, 95.1, 97.0, 98.0, 112.3, 113.8,
Processing time: 0:00:01.855483
Results for the quried mass "82.3"
| Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
| C4O1N1 | 0.219 | 4 | 0 | C2,C3,C5,C6,N7,O8 |
| C4S1 | 0.176 | 2 | 0 | C2,C3,C4,C6,S9 |
| C4S1 | 0.176 | 2 | 0 | C2,C4,C5,C6,S9 |
| C4S1 | 0.176 | 2 | 0 | C2,C3,C5,C6,S9 |
| C3S1N1 | 0.196 | 0 | 0 | C1,S9,C4,C5,N7 |
| C5O1 | 0.200 | 6 | 0 | C1,C2,C3,C5,C6,O8 |
| C3S1O1 | 0.219 | 2 | 0 | S9,C2,C3,C6,O8 |