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

Computational Annotation of MS Peaks (CAMP)

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Submission id: SM879903

Outputs for Benzotriazole; 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: SM879903
Synonyms: Benzotriazole, 1H-Benzotriazole, 2H-benzotriazole
Total mass: 119.1238
Formula: H5 C6 N3

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:
Processing time: 0:00:01.127044

Results for the quried mass "92.0495"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
C5N2	0.049	4	0	C1,C2,C3,C4,C6,N8,N9
C5N2	0.049	4	0	C1,C2,C3,C4,C5,N7,N9
C6N1	0.069	6	1	C1,C2,C3,C4,C5,C6,N8
C6N1	0.069	6	2	C1,C2,C3,C4,C5,C6,N7
C4N3	0.029	2	0	C3,C4,C5,C6,N7,N8,N9
C4N3	0.029	2	0	C2,C4,C5,C6,N7,N8,N9
C4N3	0.029	2	0	C1,C3,C5,C6,N7,N8,N9
C4N3	0.029	2	0	C1,C2,C4,C6,N7,N8,N9
C4N3	0.029	2	0	C1,C2,C3,C5,N7,N8,N9