Related entries (identical compound): OUF00289 GLS00033 GLS00034 OUF00290 KO001318 KO001315 KO001317 KO001316 MT000053

Submission id: OUF00289

Outputs for Ketovaline; GC-EI-TOF; MS; n TMS; RT:321.308 sec

Database: Engineering department, Osaka Univ.
Entry ID: OUF00289
Synonyms: Ketovaline
Total mass: 116.1149
Formula: H8 C5 O3

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS
Instrument: Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies
Instrument type: GC-EI-TOF
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks: 119.0,126.0,129.0,133.0,140.0,143.0,146.0,156.0,159.0,170.0,174.0,186.0,189.0,202.0,217.0,
Replicated queried mass peaks: 86.0, 87.0, 89.0, 90.0, 92.0, 93.0, 96.0, 97.0, 99.0, 100.0, 102.0, 103.0, 105.0, 106.0, 111.0, 112.0, 114.0, 115.0, 117.0, 118.0, 127.0, 128.0, 130.0, 131.0, 141.0, 142.0, 144.0, 147.0, 157.0, 158.0, 171.0, 172.0, 187.0, 188.0, 203.0, 204.0, 218.0,
Processing time: 0:00:00.735403
Queried mass list: ['85.000', '88.000', '91.000', '95.000', '98.000', '101.000', '104.000', '107.000', '110.000', '113.000', '116.000']

Queried mass	Num. matched formulas	Num. matched fragments
85.0	No match found!	No match found!
88.0	No match found!	No match found!
91.0 (link to fragments)	1	3
95.0 (link to fragments)	2	5
98.0 (link to fragments)	2	5
101.0 (link to fragments)	2	5
104.0	No match found!	No match found!
107.0 (link to fragments)	1	1
110.0 (link to fragments)	1	1
113.0 (link to fragments)	1	1
116.0 (link to fragments)	1	1