Related entries (identical compound): OUF00044 KZ000174 PR010219

Submission id: KZ000174

Outputs for 3,4-Dihydroxyphenylacetic acid; GC-EI-TOF; MS; 3 TMS; BP:179

Database: Kazusa DNA Research Institute
Entry ID: KZ000174
Synonyms: 3,4-Dihydroxyphenylacetic acid
Total mass: 168.1464
Formula: H8 C8 O4

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: 173.0,176.0,179.0,182.0,189.0,192.0,195.0,203.0,206.0,209.0,212.0,219.0,222.0,225.0,233.0,236.0,239.0,249.0,252.0,255.0,263.0,266.0,269.0,280.0,283.0,294.0,297.0,339.0,342.0,368.0,371.0,383.0,386.0,
Replicated queried mass peaks: 83.0, 84.0, 86.0, 87.0, 89.0, 90.0, 92.0, 93.0, 96.0, 97.0, 100.0, 101.0, 103.0, 104.0, 106.0, 107.0, 111.0, 115.0, 117.0, 118.0, 120.0, 121.0, 123.0, 131.0, 133.0, 134.0, 136.0, 137.0, 145.0, 147.0, 148.0, 150.0, 151.0, 153.0, 159.0, 161.0, 162.0, 164.0, 165.0, 167.0, 175.0, 177.0, 178.0, 180.0, 181.0, 183.0, 191.0, 193.0, 194.0, 196.0, 197.0, 205.0, 207.0, 208.0, 210.0, 211.0, 220.0, 221.0, 223.0, 224.0, 226.0, 227.0, 234.0, 235.0, 237.0, 238.0, 240.0, 241.0, 250.0, 251.0, 253.0, 254.0, 256.0, 264.0, 265.0, 267.0, 268.0, 270.0, 271.0, 281.0, 282.0, 284.0, 295.0, 296.0, 340.0, 341.0, 343.0, 344.0, 369.0, 370.0, 372.0, 384.0, 385.0, 387.0, 388.0,
Processing time: 0:00:01.868264
Queried mass list: ['82.000', '85.000', '88.000', '91.000', '95.000', '99.000', '102.000', '105.000', '109.000', '113.000', '116.000', '119.000', '122.000', '129.000', '132.000', '135.000', '143.000', '146.000', '149.000', '152.000', '157.000', '160.000', '163.000', '166.000']

Queried mass	Num. matched formulas	Num. matched fragments
82.0 (link to fragments)	2	18
85.0 (link to fragments)	2	10
88.0	No match found!	No match found!
91.0 (link to fragments)	1	3
95.0 (link to fragments)	1	3
99.0 (link to fragments)	1	3
102.0	No match found!	No match found!
105.0 (link to fragments)	1	2
109.0 (link to fragments)	2	3
113.0 (link to fragments)	1	1
116.0 (link to fragments)	1	1
119.0 (link to fragments)	2	3
122.0 (link to fragments)	2	3
129.0	No match found!	No match found!
132.0 (link to fragments)	1	2
135.0 (link to fragments)	2	3
143.0 (link to fragments)	2	5
146.0 (link to fragments)	1	4
149.0 (link to fragments)	2	7
152.0 (link to fragments)	2	7
157.0 (link to fragments)	1	3
160.0 (link to fragments)	1	1
163.0 (link to fragments)	1	1
166.0 (link to fragments)	1	1