MassBank Record: CB000288



 Chloramphenicol; LC-ESI-QQQ; MS; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: CB000288
RECORD_TITLE: Chloramphenicol; LC-ESI-QQQ; MS; [M+H]+
DATE: 2018.04.04
AUTHORS: Nogawa TCSRS, RIKEN, Okano ACSRS, RIKEN, CSRS, RIKEN
LICENSE: BY-CC
COMMENT: Origin: Microbe, Propylene glycols, Nitrobenzenes

CH$NAME: Chloramphenicol CH$COMPOUND_CLASS: Carbohydrates CH$FORMULA: C11H12Cl2N2O5 CH$EXACT_MASS: 323.13469000000003 CH$SMILES: O=[N+]([O-])c1ccc(C(O)C(CO)N=C(O)C(Cl)Cl)cc1 CH$IUPAC: InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18) CH$LINK: CAS 56-75-7 CH$LINK: PUBCHEM CID:5744 128822 CH$LINK: INCHIKEY WIIZWVCIJKGZOK-UHFFFAOYSA-N
AC$INSTRUMENT: ABSciex API3200 LC/MS system AC$INSTRUMENT_TYPE: LC-ESI-QQQ AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0006-0936000000-eb7d9f92993b3f8b388a PK$NUM_PEAK: 123 PK$PEAK: m/z int. rel.int. 114.0000 36031.9844 21 114.8000 64033.9844 39 142.0000 366702.5625 232 142.1000 808557.7500 514 142.2000 1327006.5000 845 142.3000 1567288.3750 999 142.4000 1378274.8750 878 142.5000 912947.5625 581 142.6000 204455.7813 129 142.7000 170688.6406 107 142.8000 90388.8047 56 142.9000 76799.5859 48 143.0000 114684.6641 72 143.1000 58886.5664 36 143.2000 116331.8359 73 143.3000 45503.2500 28 143.4000 47768.1211 29 149.4000 82770.6094 51 149.7000 46944.5273 28 157.7000 37885.0586 23 164.6000 66504.7578 41 164.7000 71240.3828 44 164.8000 58268.8672 36 164.9000 57033.4844 35 165.0000 58680.6563 36 165.1000 59092.4570 36 165.3000 39326.3398 24 212.7000 46738.6289 28 212.8000 45297.3516 27 212.9000 38502.7500 23 213.1000 39326.3398 24 213.2000 114684.6641 72 213.3000 268283.8750 170 213.4000 36855.5742 22 226.7000 41385.3086 25 239.1000 95948.0156 60 239.2000 165541.2344 104 241.3000 37267.3672 22 274.2000 40355.8242 24 274.3000 74328.8359 46 274.4000 93271.3672 58 274.5000 148451.7813 93 274.6000 105419.3047 66 274.7000 131980.0313 83 274.8000 134039.0000 84 274.9000 127038.4766 80 275.0000 146804.6094 92 275.1000 111596.2031 70 275.2000 100065.9688 62 275.3000 46532.7344 28 276.3000 53739.1367 33 276.4000 72269.8672 45 276.5000 57651.1758 35 276.6000 53739.1367 33 276.7000 108507.7500 68 276.8000 71652.1797 44 276.9000 65269.3750 40 277.0000 37885.0586 23 277.1000 37267.3672 22 277.2000 180365.8125 114 277.3000 53739.1367 33 279.1000 44679.6641 27 286.6000 52297.8555 32 286.7000 66504.7578 41 286.9000 37061.4727 22 304.4000 81535.2266 51 304.5000 67328.3359 41 304.6000 62798.6133 39 304.7000 65475.2773 40 304.8000 65475.2773 40 304.9000 65269.3750 40 305.0000 88741.6172 55 305.1000 37473.2617 22 305.2000 157717.1406 99 305.3000 58680.6563 36 306.5000 59916.0391 37 306.6000 82152.9219 51 306.7000 67328.3359 41 306.8000 115714.1563 72 306.9000 80711.6484 50 307.0000 100889.5547 63 307.1000 38914.5430 23 307.2000 130332.8281 82 307.3000 180571.7188 114 322.3000 101301.3516 63 322.4000 134862.5781 85 322.5000 218662.6875 138 322.6000 275284.4063 174 322.7000 259430.2969 164 322.8000 245223.3906 155 322.9000 254076.9531 161 323.0000 336847.5625 213 323.1000 161629.2031 102 323.2000 158128.9375 99 323.3000 156687.6563 98 323.4000 103772.1172 65 323.5000 74740.6328 46 323.6000 55592.2148 34 324.0000 40767.6133 25 324.1000 54562.7227 33 324.2000 109949.0313 69 324.3000 74328.8359 46 324.4000 150922.5469 95 324.5000 192101.9531 121 324.6000 128067.9688 80 324.7000 135686.1719 85 324.8000 150304.8594 94 324.9000 239870.0938 152 325.0000 234104.9531 148 325.1000 128479.7656 80 325.2000 124361.8125 78 325.3000 108919.5547 68 325.4000 40767.6133 25 325.5000 48179.9102 29 326.9000 38502.7500 23 327.3000 37473.2617 22 644.7000 41385.3086 25 644.8000 34796.6055 21 646.6000 48591.7070 30 646.7000 69593.2109 43 647.0000 41591.2070 25 648.6000 48797.5977 30 648.7000 55592.2148 34 //