Related entries (identical compound): KNA00284 KNA00285 KNA00577 KNA00579 BML80328 OUF00206 BML01842 BML80326 BML80327 BML80325 PR100092 PR100091 PR010128 BML01812 KZ000173 KNA00684 KNA00685 BML01832 KNA00578 BML01802 BML01852 KNA00173 KNA00175 KNA00576 BML01822

Submission id: KNA00577

Outputs for DOPA; LC-ESI-ITFT; MS2; m/z:196.06; NEG

Database: Graduate School of Information Science, NAIST
Entry ID: KNA00577
Synonyms: 3,4-Dihydroxy-L-phenylalanine, L-Dopa, 3-Hydroxy-L-tyrosine, L-beta-(3,4-Dihydroxyphenyl)alanine, Levodopa, Dihydroxy-L-phenylalanine, DOPA
Total mass: 197.1875
Formula: H11 C9 O4 N1

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: 123.10257, 125.033691, 135.055786, 152.056534,
Processing time: 0:00:01.798573
Queried mass list: ['72.028', '81.011', '91.113', '107.103', '109.125', '122.011', '124.179', '134.106', '150.139', '179.002']

Queried mass	Num. matched formulas	Num. matched fragments
72.027634 (link to fragments)	4	19
81.011444 (link to fragments)	5	31
91.113022 (link to fragments)	5	41
107.103424 (link to fragments)	2	3
109.124542 (link to fragments)	2	3
122.010696 (link to fragments)	2	3
124.17865 (link to fragments)	2	3
134.106293 (link to fragments)	2	2
150.138519 (link to fragments)	2	3
179.002243 (link to fragments)	3	8