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Processed databases
Atom-Mass pairs
Related entries (identical compound): OUF00145 PR100112 KO000422 KO002550 KO002551 KO000423 KO002549 KO002548 KO000424 KO000425 KO000421 KO002547 MT000127 UF412503 UF412502 UF412501 UF412504 SM868004
Submission id: KO002548

Outputs for Creatinine; LC-ESI-QQ; MS2; CE:20 V; [M+H]+


Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO002548
Synonyms: Creatinine, 1-Methylglycocyamidine
Total mass: 113.1176
Formula: H7 C4 O1 N3

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 44.0, 61.0, 66.5, 97.0,
Processing time: 0:00:01.507988
Queried mass list: ['36.500', '40.800', '42.900', '49.900', '55.200', '57.600', '60.200', '66.200', '69.100', '72.200', '79.000', '86.200', '95.300', '103.800', '114.200']



Queried massNum. matched formulasNum. matched fragments
36.5 (link to fragments) 1 4
40.8 (link to fragments) 4 8
42.9 (link to fragments) 3 4
49.9 (link to fragments) 1 2
55.2 (link to fragments) 2 2
57.6 (link to fragments) 2 2
60.2 No match found! No match found!
66.2 (link to fragments) 4 4
69.1 (link to fragments) 4 4
72.2 (link to fragments) 1 1
79.0 (link to fragments) 2 3
86.2 (link to fragments) 1 1
95.3 (link to fragments) 3 5
103.8 No match found! No match found!
114.2 (link to fragments) 1 1


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