MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005763
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005763
RECORD_TITLE: PROMAZINE; EI-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$NAME: PROMAZINE
CH$NAME: N,N-DIMETHYL-10H-PHENOTHIAZINE-10-PROPANAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C17H20N2S
CH$EXACT_MASS: 284.13472
CH$SMILES: CN(C)CCCN(c21)c(c3)c(ccc3)Sc(cccc2)1
CH$IUPAC: InChI=1S/C17H20N2S/c1-18(2)12-7-13-19-14-8-3-5-10-16(14)20-17-11-6-4-9-15(17)19/h3-6,8-11H,7,12-13H2,1-2H3
CH$LINK: CAS
58-40-2
CH$LINK: INCHIKEY
ZGUGWUXLJSTTMA-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID2023517
AC$INSTRUMENT: JEOL JMS-D-300
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-053i-9470000000-c8ea76fcc1b124b82db0
PK$NUM_PEAK: 52
PK$PEAK: m/z int. rel.int.
52 1.28 13
56 1.3 13
57 1.99 20
58 99.99 999
59 5.6 56
63 1.46 15
65 1.12 11
69 2.13 21
70 4.28 43
71 2.31 23
72 3.77 38
77 2.17 22
84 4.82 48
85 16.73 167
86 39.33 393
87 0.23 2
109 1.33 13
127 2.08 21
128 1.37 14
139 1.66 17
140 1.36 14
152 2.25 23
153 1.72 17
154 4.07 41
166 2.83 28
167 3.96 40
171 1.76 18
178 1.23 12
179 2.59 26
180 10.72 107
181 1.78 18
184 1.31 13
196 1.2 12
197 2.61 26
198 16.92 169
199 27.08 271
200 4.51 45
201 1.4 14
210 1.95 20
212 9.59 96
213 5.88 59
214 1.2 12
223 2.61 26
224 5.28 53
225 5.92 59
226 3.39 34
238 28.51 285
239 11.57 116
240 3.06 31
284 57.28 573
285 12.17 122
286 3.74 37
//