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Atom-Mass pairs
Submission id: SM862301

Outputs for Benzocaine; LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+


Database: Critical Assessment of Small Molecule Identification 2016, Mass Spectrometry Society of Japan
Entry ID: SM862301
Synonyms: Benzocaine, Benzocain, ethyl 4-aminobenzoate
Total mass: 165.1887
Formula: H11 C9 O2 N1

Experimental information


MS type: MS2
Instrument: Q Exactive Plus Orbitrap Thermo Scientific
Instrument type: LC-ESI-QFT
Ionization: ESI
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 67.0542, 93.0573, 94.0651,
Processing time: 0:00:02.330818

Results for the quried mass "65.0385"

FormulaMass differencesNum. used protonsNum. required extra protonsAtom names
C4N1 0.035 3 0 C3,C5,C6,C8,N10
C4N1 0.035 3 0 C3,C5,C7,C8,N10
C4N1 0.035 3 0 C4,C5,C6,C8,N10
C4N1 0.035 3 0 C4,C6,C7,C8,N10
C4O1 0.012 1 0 C2,C3,C7,C9,O12
C4O1 0.012 1 0 C2,C4,C7,C9,O12
C4O1 0.012 1 0 C1,C2,C7,C9,O12
C4O1 0.012 1 0 C3,C4,C7,C9,O11
C4O1 0.012 1 0 C3,C4,C7,C9,O12
C4O1 0.012 1 0 C3,C5,C7,C9,O11
C4O1 0.012 1 0 C3,C5,C7,C9,O12
C4O1 0.012 1 0 C4,C6,C7,C9,O11
C4O1 0.012 1 0 C4,C6,C7,C9,O12
C5 0.055 5 1 C3,C4,C5,C6,C8
C5 0.055 5 2 C3,C4,C6,C7,C8
C5 0.055 5 1 C3,C4,C5,C6,C7
C5 0.055 5 2 C3,C4,C6,C7,C9
C5 0.055 5 2 C3,C4,C5,C7,C8
C5 0.055 5 2 C3,C5,C6,C7,C8
C5 0.055 5 2 C3,C4,C5,C7,C9
C5 0.055 5 2 C4,C5,C6,C7,C8


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