NAME: 2,4,5-TRICHLOROPHENOL
SYNONYM: 2,4,5-TRICHLOROPHENOL
DB#: JP000009
INCHIKEY: LHJGJYXLEPZJPM-UHFFFAOYSA-N
MW: 195.924947756
FORMULA: C6H3Cl3O
PRECURSORMZ: 0
ACCESSION: JP000009
AUTHOR: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA
INSTRUMENT: VARIAN MAT-44
SMILES: Oc(c1)c(Cl)cc(Cl)c(Cl)1
INCHI: InChI=1S/C6H3Cl3O/c7-3-1-5(9)6(10)2-4(3)8/h1-2,10H
SMILES_2: [H]OC1=C([H])C(Cl)=C(Cl)C([H])=C1Cl
EXACT_MASS: 195.92495
INSTRUMENT_TYPE: EI-B
MS_LEVEL: MS1
IONIZATION_ENERGY: 70 eV
ION_TYPE: [M]+*
IONIZATION_MODE: positive
LAST_AUTO-CURATION: 1495210336033
MOLECULAR_FORMULA: C6H3Cl3O
TOTAL_EXACT_MASS: 195.924947756
NUM PEAKS: 65
51.0	2.58
53.0	14.73
59.0	2.03
60.0	12.75
61.0	30.62
62.0	36.79
63.0	19.11
64.0	2.15
65.0	5.23
66.0	13.42
67.0	7.46
69.0	2.46
71.0	6.55
72.0	13.85
73.0	16.02
74.0	7.55
75.0	4.47
79.0	2.34
80.0	8.06
81.0	5.21
82.0	3.22
83.0	7.1
84.0	6.05
85.0	6.38
86.0	2.53
87.0	3.44
89.0	1.93
95.0	3.8
96.0	33.63
97.0	67.27
98.0	25.02
99.0	31.7
100.0	5.86
106.0	2.03
107.0	8.66
108.0	3.94
109.0	6.55
131.0	12.51
132.0	48.06
133.0	32.0
134.0	33.42
135.0	18.37
136.0	6.55
137.0	2.96
149.0	6.48
151.0	3.39
160.0	10.69
161.0	4.76
162.0	10.76
163.0	3.58
164.0	3.61
167.0	4.06
169.0	3.89
177.0	4.76
179.0	2.94
192.0	6.69
194.0	4.64
195.0	6.79
196.0	99.99
197.0	11.45
198.0	92.58
199.0	7.82
200.0	29.54
201.0	2.08
202.0	3.15