MassBank Record: JP005776



 CHLORPROMAZINE; CI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP005776
RECORD_TITLE: CHLORPROMAZINE; CI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: , HAMAMATSU UNIV. SCHOOL OF MEDICINE
LICENSE: CC BY-NC-SA

CH$NAME: CHLORPROMAZINE CH$NAME: 2-CHLORO-N,N-DIMETHYL-10H-PHENOTHIAZINE-10-PROPANAMINE CH$COMPOUND_CLASS: N/A CH$FORMULA: C17H19ClN2S CH$EXACT_MASS: 318.09575 CH$SMILES: CN(C)CCCN(c21)c(c3)c(ccc(Cl)3)Sc(cccc2)1 CH$IUPAC: InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3 CH$LINK: INCHIKEY ZPEIMTDSQAKGNT-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID0022808
AC$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: splash10-014i-2019000000-54e008f9fc11d7f45b68 PK$NUM_PEAK: 42 PK$PEAK: m/z int. rel.int. 52 1.03 10 57 1.58 16 58 44.39 444 60 2.25 23 71 2.06 21 72 3.69 37 74 1.23 12 84 1.84 18 85 2.66 27 86 31.41 314 87 2.01 20 111 1.03 10 149 1.53 15 198 1.75 18 199 1.57 16 200 1.51 15 226 1.9 19 233 3.23 32 234 3.64 36 235 1.87 19 236 1.66 17 240 1.01 10 246 1.52 15 248 2.77 28 250 1 10 262 1.17 12 274 1.31 13 276 1.25 13 283 6.41 64 284 6.01 60 285 7.05 71 286 1.79 18 317 10.8 108 318 67.76 678 319 99.99 999 320 45.13 451 321 39.32 393 322 8.72 87 323 2.64 26 347 9.89 99 348 2.27 23 349 3.66 37 //

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