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Atom-Mass pairs
Related entries (identical compound): JP001132 BML80987 BML80985 JP009576 PB004701 PB004703 PB004702 BML01366 BML01352 SM817901 FIO00035 FIO00034 JP007406 FIO00037 FIO00036 FIO00033 BML01359
Submission id: PB004703

Outputs for Coumarin; LC-ESI-QQ; MS2; CE:28 eV; [M+H]+


Database: Institute of Plant Biochemistry, Halle, Germany
Entry ID: PB004703
Synonyms: Coumarin , chromen-2-one
Total mass: 146.1425
Formula: H6 C9 O2

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: TSQ QUANTUM AM
Instrument type: LC-ESI-QQ
Ionization: ESI
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 40.0, 41.0, 43.0, 44.0, 47.0, 56.0, 57.0, 61.0, 64.0, 65.0, 69.0, 77.0, 84.0, 102.0, 103.0, 107.0, 111.0, 119.0,
Processing time: 0:00:01.893398
Queried mass list: ['39.000', '42.000', '45.000', '51.000', '55.000', '60.000', '63.000', '67.000', '75.000', '82.000', '85.000', '91.000', '97.000', '101.000', '106.000', '109.000', '117.000', '129.000', '132.000', '147.000']



Queried massNum. matched formulasNum. matched fragments
39.0 (link to fragments) 2 15
42.0 (link to fragments) 2 6
45.0 (link to fragments) 1 1
51.0 (link to fragments) 2 21
55.0 (link to fragments) 2 10
60.0 (link to fragments) 1 15
63.0 (link to fragments) 2 31
67.0 (link to fragments) 2 20
75.0 (link to fragments) 2 5
82.0 (link to fragments) 2 5
85.0 (link to fragments) 1 2
91.0 (link to fragments) 3 9
97.0 (link to fragments) 2 5
101.0 (link to fragments) 2 3
106.0 (link to fragments) 2 8
109.0 (link to fragments) 1 6
117.0 (link to fragments) 2 9
129.0 (link to fragments) 2 9
132.0 (link to fragments) 2 9
147.0 (link to fragments) 1 1


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