MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005785
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005785
RECORD_TITLE: ETHOPROPAZINE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAMAMATSU UNIV. SCHOOL OF MEDICINE
LICENSE: CC BY-NC-SA
CH$NAME: ETHOPROPAZINE
CH$NAME: 10-(2-DIETHYLAMINOPROPYL)PHENOTHIAZINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C19H24N2S
CH$EXACT_MASS: 312.16602
CH$SMILES: CCN(CC)C(C)CN(c21)c(c3)c(ccc3)Sc(cccc2)1
CH$IUPAC: InChI=1S/C19H24N2S/c1-4-20(5-2)15(3)14-21-16-10-6-8-12-18(16)22-19-13-9-7-11-17(19)21/h6-13,15H,4-5,14H2,1-3H3
CH$LINK: CAS
522-00-9
CH$LINK: INCHIKEY
CDOZDBSBBXSXLB-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID2023018
AC$INSTRUMENT: JEOL JMS-D-300
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 200 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE
PK$SPLASH: splash10-0w29-2971000000-c72e808a24ef57c33eef
PK$NUM_PEAK: 79
PK$PEAK: m/z int. rel.int.
51 1.17 12
52 4.76 48
60 14.52 145
61 3.7 37
63 3.05 31
72 4 40
79 1.88 19
84 4.82 48
86 2.11 21
91 1.35 14
94 1.29 13
98 2.58 26
99 10.41 104
100 99.99 999
101 7.29 73
102 2.11 21
107 1.7 17
111 1 10
112 3.17 32
113 2.11 21
114 45.52 455
115 2.76 28
122 1.29 13
126 2.11 21
127 1.41 14
128 13.58 136
129 2.17 22
136 1.47 15
138 1.17 12
140 3.23 32
148 1.11 11
153 1.17 12
154 1.58 16
164 1 10
166 1.29 13
167 1 10
170 2.52 25
180 1 10
181 1.05 11
183 1.35 14
184 1.58 16
198 3.35 34
199 30.41 304
200 60.17 602
201 9.64 96
202 2.88 29
210 1.05 11
212 1.11 11
213 20.52 205
214 32.17 322
215 7.29 73
216 3.17 32
217 1.64 16
226 1.7 17
227 3.05 31
228 16.41 164
229 2.17 22
230 1.88 19
238 1 10
239 1.76 18
240 5.82 58
241 2.35 24
242 5.52 55
243 1.82 18
244 2.29 23
254 1.41 14
256 2.52 25
257 1.82 18
268 1.7 17
270 1.35 14
283 1.41 14
297 2.41 24
298 1.23 12
311 5.41 54
312 5.7 57
313 21.82 218
314 5.88 59
315 2.88 29
341 2.52 25
//