Related entries (identical compound): KO003621 KO003620 KO009126 KO009127 KO009128 KO009129 KO003618 KO003619 KO003617

Submission id: KO003620

Outputs for Neostigmine; LC-ESI-QQ; MS2; CE:40 V; [M+H]+

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003620
Synonyms: Neostigmine, Neostigmine bromide, Neo proserine
Total mass: 223.2907
Formula: H19 C12 O2 N2

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 44.0, 57.0, 70.3, 73.9, 79.4, 80.8, 83.8, 88.1, 90.9, 93.1, 94.1, 95.5, 105.7, 108.2, 110.0, 111.1, 118.2, 120.0, 122.2, 123.3, 134.0, 136.2, 138.4, 148.1, 150.3, 151.2, 164.3, 165.1, 179.0, 193.2, 208.2,
Processing time: 0:00:03.881686
Queried mass list: ['43.300', '56.000', '58.100', '60.200', '65.100', '68.800', '72.000', '76.900', '79.000', '83.100', '86.700', '90.000', '92.300', '95.000', '98.700', '103.700', '107.000', '109.100', '117.100', '119.200', '121.300', '124.500', '132.500', '135.100', '137.200', '146.300', '149.400', '152.300', '163.400', '166.300', '178.300', '191.400', '207.400', '223.400']

Queried mass	Num. matched formulas	Num. matched fragments
43.3 (link to fragments)	3	7
56.0 (link to fragments)	3	8
58.1 (link to fragments)	3	11
60.2 (link to fragments)	2	10
65.1 (link to fragments)	4	18
68.8 (link to fragments)	4	12
72.0 (link to fragments)	3	6
76.9 (link to fragments)	4	24
79.0 (link to fragments)	4	26
83.1 (link to fragments)	3	7
86.7 (link to fragments)	3	8
90.0 (link to fragments)	4	20
92.3 (link to fragments)	5	26
95.0 (link to fragments)	5	16
98.7 (link to fragments)	5	9
103.7 (link to fragments)	5	25
107.0 (link to fragments)	6	27
109.1 (link to fragments)	7	17
117.1 (link to fragments)	5	13
119.2 (link to fragments)	2	3
121.3 (link to fragments)	3	4
124.5 (link to fragments)	3	4
132.5 (link to fragments)	2	3
135.1 (link to fragments)	2	3
137.2 (link to fragments)	3	4
146.3 (link to fragments)	2	2
149.4 (link to fragments)	2	2
152.3 (link to fragments)	3	3
163.4 (link to fragments)	1	1
166.3 (link to fragments)	2	2
178.3 (link to fragments)	3	4
191.4 (link to fragments)	3	12
207.4 (link to fragments)	3	11
223.4 (link to fragments)	1	1