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Atom-Mass pairs
Related entries (identical compound): KO001798 KO001795 KO001794 KO001797 KO001796 KO003983 KO003986 KO003984 KO003985 GLS00131 KO003982 OUF00464 JP003897
Submission id: KO001797

Outputs for Suberic acid; LC-ESI-QQ; MS2; CE:40 V; [M-H]-


Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001797
Synonyms: Suberate, 1,8-Octanedioic acid, Cork acid, Suberic acid, Octanedioic acid, 1,6-Hexanedicarboxylic acid
Total mass: 174.1938
Formula: H14 C8 O4

Structure file (with ALATIS unique atom labels)

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: 59.3, 83.0, 111.1,
Processing time: 0:00:01.508503
Queried mass list: ['57.300', '66.700', '78.600', '81.300', '109.100']



Queried massNum. matched formulasNum. matched fragments
57.3 (link to fragments) 3 9
66.7 (link to fragments) 3 10
78.6 (link to fragments) 3 9
81.3 (link to fragments) 3 9
109.1 (link to fragments) 1 2


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