Paeonol; GC-EI-TOF; MS; n TMS; RT:625.978 sec

Computational Annotation of MS Peaks (CAMP)

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Submission id: OUF00411

Outputs for Paeonol; GC-EI-TOF; MS; n TMS; RT:625.978 sec

Database: Engineering department, Osaka Univ.
Entry ID: OUF00411
Synonyms: Paeonol
Total mass: 166.1735
Formula: H10 C9 O3

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: 176.0,179.0,182.0,189.0,192.0,195.0,198.0,204.0,207.0,210.0,218.0,221.0,224.0,229.0,234.0,237.0,241.0,244.0,252.0,263.0,266.0,269.0,303.0,348.0,354.0,360.0,365.0,372.0,376.0,380.0,390.0,398.0,404.0,412.0,426.0,434.0,467.0,491.0,
Replicated queried mass peaks: 86.0, 87.0, 89.0, 90.0, 92.0, 93.0, 95.0, 96.0, 98.0, 99.0, 101.0, 102.0, 104.0, 105.0, 107.0, 108.0, 110.0, 111.0, 114.0, 115.0, 117.0, 118.0, 120.0, 121.0, 123.0, 124.0, 126.0, 130.0, 132.0, 133.0, 135.0, 136.0, 138.0, 139.0, 146.0, 147.0, 149.0, 150.0, 152.0, 153.0, 160.0, 161.0, 163.0, 164.0, 166.0, 167.0, 177.0, 178.0, 180.0, 181.0, 183.0, 190.0, 191.0, 193.0, 194.0, 196.0, 197.0, 205.0, 206.0, 208.0, 209.0, 211.0, 219.0, 220.0, 222.0, 223.0, 225.0, 231.0, 236.0, 238.0, 242.0, 253.0, 254.0, 267.0, 268.0, 270.0,
Processing time: 0:00:01.991553

Results for the quried mass "116.0"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
C7O2	0.074	0	0	C1,C2,C3,C4,C6,C7,C8,O10,O12
C7O2	0.074	0	0	C2,C3,C4,C5,C7,C8,C9,O11,O12
C7O2	0.074	0	0	C1,C3,C4,C5,C6,C8,C9,O10,O11