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Atom-Mass pairs
Related entries (identical compound): OUF00140 KNA00814 KNA00813 KZ000115 KZ000114 PR010003 KO000385 KO000384 KO000381 KO000383 KO000382 KNA00812 KNA00552 KNA00550 KNA00551 MT000044 PR100481 KZ000018
Submission id: KNA00814

Outputs for Citric acid; LC-ESI-ITFT; MS2; m/z:191.02; NEG


Database: Graduate School of Information Science, NAIST
Entry ID: KNA00814
Synonyms: Citrate, Citric acid, 2-Hydroxy-1,2,3-propanetricarboxylic acid, 2-Hydroxytricarballylic acid
Total mass: 192.1232
Formula: H8 C6 O7

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: LTQ Orbitrap XL, Thermo Scientfic
Instrument type: LC-ESI-ITFT
Ionization: ESI
Ionization mode: NEGATIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 87.057983,
Processing time: 0:00:01.506024
Queried mass list: ['85.234', '101.031', '110.960', '128.978', '130.994', '155.055', '163.085', '172.999']



Queried massNum. matched formulasNum. matched fragments
85.234039 (link to fragments) 2 19
101.030975 (link to fragments) 1 16
110.960251 No match found! No match found!
128.977707 (link to fragments) 1 2
130.993515 (link to fragments) 1 2
155.055267 No match found! No match found!
163.085403 No match found! No match found!
172.998764 (link to fragments) 1 7


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