MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005770
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005770
RECORD_TITLE: PROCHLORPERAZINE; 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$NAME: PROCHLORPERAZINE
CH$NAME: 2-CHLORO-10-(3-(4-METHYL-1-PIPERAZINYL)PROPYL)-10H-PHENOTHIAZINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C20H24ClN3S
CH$EXACT_MASS: 373.13795
CH$SMILES: CN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc(Cl)3)Sc(cccc2)1
CH$IUPAC: InChI=1S/C20H24ClN3S/c1-22-11-13-23(14-12-22)9-4-10-24-17-5-2-3-6-19(17)25-20-8-7-16(21)15-18(20)24/h2-3,5-8,15H,4,9-14H2,1H3
CH$LINK: CAS
58-38-8
CH$LINK: INCHIKEY
WIKYUJGCLQQFNW-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7023514
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$SPLASH: splash10-0229-7933000000-4e14a9a9728c361941d3
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
56 7.54 75
57 4.06 41
58 14.45 145
70 85.09 851
71 18.03 180
72 1.77 18
84 5.09 51
85 5.48 55
97 1.77 18
99 3.12 31
111 3.45 35
113 99.99 999
114 6.83 68
127 15.03 150
141 47.67 477
198 6.41 64
214 6.38 64
232 11.03 110
233 15.93 159
234 3.03 30
235 3.29 33
246 3.96 40
247 2.16 22
259 2.06 21
260 1.9 19
272 6.7 67
273 4.16 42
274 1.58 16
373 44.48 445
374 7.19 72
375 13.96 140
//