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Atom-Mass pairs
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Submission id: KO001815
Outputs for Syringic acid; LC-ESI-QQ; MS2; CE:40 V; [M-H]-
Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001815
Synonyms: Syringate, Syringic acid
Total mass: 198.1723
Formula: H10 C9 O5
Experimental information
MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: NEGATIVE
CAMP general report:
Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 90.9, 122.9,
Processing time: 0:00:01.533375
Results for the quried mass "78.1"
Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C5,C7,C8,O10 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C5,C6,C8,O10 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C5,C7,C9,O11 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C5,C7,C9,O12 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C5,C6,C7,O13 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C5,C7,C8,O14 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C5,C7,C9,O14 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C5,C6,C7,O14 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C6,C7,C8,O14 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C6,C7,C8,O10 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C6,C7,C8,O13 |
C5O1 |
0.031 |
2 |
1 |
C3,C5,C6,C7,C8,O14 |
C5O1 |
0.031 |
2 |
0 |
C3,C5,C6,C8,C9,O10 |
C5O1 |
0.031 |
2 |
1 |
C3,C5,C6,C8,C9,O11 |
C5O1 |
0.031 |
2 |
0 |
C3,C5,C6,C8,C9,O12 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C5,C6,C9,O11 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C5,C6,C9,O12 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C5,C6,C9,O13 |
C5O1 |
0.031 |
2 |
1 |
C3,C5,C6,C7,C8,O13 |
C5O1 |
0.031 |
2 |
0 |
C3,C4,C5,C6,C8,O13 |
C5O1 |
0.031 |
2 |
1 |
C3,C5,C6,C8,C9,O13 |
C5O1 |
0.031 |
2 |
1 |
C4,C5,C6,C7,C8,O13 |
C5O1 |
0.031 |
2 |
0 |
C4,C5,C7,C8,C9,O10 |
C5O1 |
0.031 |
2 |
1 |
C4,C5,C7,C8,C9,O11 |
C5O1 |
0.031 |
2 |
0 |
C4,C5,C7,C8,C9,O12 |
C5O1 |
0.031 |
2 |
1 |
C4,C5,C6,C7,C8,O14 |
C5O1 |
0.031 |
2 |
1 |
C4,C5,C7,C8,C9,O14 |
C5O1 |
0.031 |
2 |
0 |
C3,C5,C6,C7,C8,O10 |
C5O1 |
0.031 |
2 |
0 |
C4,C5,C6,C7,C8,O10 |
C4O2 |
0.074 |
2 |
1 |
C3,C5,C6,C9,O11,O13 |
C4O2 |
0.074 |
2 |
0 |
C3,C5,C6,C9,O12,O13 |
C4O2 |
0.074 |
2 |
0 |
C3,C6,C7,C8,O10,O14 |
C4O2 |
0.074 |
2 |
1 |
C3,C6,C7,C8,O13,O14 |
C4O2 |
0.074 |
2 |
0 |
C3,C5,C6,C8,O10,O13 |
C4O2 |
0.074 |
2 |
1 |
C4,C5,C7,C9,O11,O14 |
C4O2 |
0.074 |
2 |
0 |
C4,C5,C7,C9,O12,O14 |
C4O2 |
0.074 |
2 |
0 |
C4,C6,C7,C8,O10,O13 |
C4O2 |
0.074 |
2 |
1 |
C4,C6,C7,C8,O13,O14 |
C4O2 |
0.074 |
2 |
0 |
C4,C5,C7,C8,O10,O14 |
C4O2 |
0.074 |
2 |
0 |
C3,C5,C6,C9,O11,O12 |
C4O2 |
0.074 |
2 |
0 |
C4,C5,C7,C9,O11,O12 |
C4O2 |
0.074 |
2 |
0 |
C1,C6,C7,C8,O13,O14 |
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