MassBank Record: NGA00964



 Cycloheximide; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: NGA00964
RECORD_TITLE: Cycloheximide; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
DATE: 2018.04.04
AUTHORS: Nogawa TCSRS, RIKEN, Okano ACSRS, RIKEN, CSRS, RIKEN
LICENSE: BY-CC
COMMENT: Origin: Microbe
COMMENT: SubCategory_DNP: Alkaloids derived from lysine, Piperidine alkaloids

CH$NAME: Cycloheximide CH$COMPOUND_CLASS: Alkaloids CH$FORMULA: C15H23NO4 CH$EXACT_MASS: 281.35486000000003 CH$SMILES: CC1C[C@H](C)C(=O)[C@H]([C@H](O)CC2CC(=O)N=C(O)C2)C1 CH$IUPAC: InChI=1S/C15H23NO4/c1-8-3-9(2)15(20)11(4-8)12(17)5-10-6-13(18)16-14(19)7-10/h8-12,17H,3-7H2,1-2H3,(H,16,18,19)/t8?,9-,11-,12+/m0/s1 CH$LINK: CAS 66-81-9 CH$LINK: PUBCHEM CID:5962 CH$LINK: INCHIKEY YPHMISFOHDHNIV-IDHBKJTRSA-N
AC$INSTRUMENT: Agilent 6410 Triple Quadrupole LC/MS system AC$INSTRUMENT_TYPE: LC-ESI-QQQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-01q9-0090000000-38f8639eaddcce33f3c6 PK$NUM_PEAK: 76 PK$PEAK: m/z int. rel.int. 218.7 2.81 2 218.8 4.35 4 218.9 6.09 6 219.0 7.39 7 219.1 8.03 8 219.2 8.13 8 219.3 7.52 7 219.4 5.84 5 219.5 3.34 3 228.8 3.09 3 228.9 4.63 4 229.0 6.19 6 229.1 7.24 7 229.2 7.28 7 229.3 6.19 6 229.4 4.33 4 229.5 2.34 2 245.4 1.08 1 245.5 2.27 2 245.6 4.58 4 245.7 9.25 9 245.8 16.98 16 245.9 26.43 26 246.0 34.56 34 246.1 38.86 38 246.2 39.26 39 246.3 36.94 36 246.4 31.83 31 246.5 23.25 23 246.6 13.25 13 246.9 9.63 9 247.0 13.52 13 247.1 15.87 15 247.2 16.85 16 247.3 16.24 16 247.4 13.16 13 247.5 7.89 7 247.6 2.64 2 263.3 0.79 0 263.4 2.43 2 263.5 4.82 4 263.6 8.14 8 263.7 13.97 13 263.8 24.53 24 263.9 40.09 40 264.0 56.89 56 264.1 68.98 68 264.2 72.84 72 264.3 68.57 68 264.4 57.07 57 264.5 39.52 39 264.6 20.63 20 264.9 9.65 9 265.0 15.16 15 265.1 18.37 18 265.2 19.11 19 265.3 18.04 18 265.4 15.14 15 265.5 10.3 10 265.6 4.76 4 265.7 0.75 0 281.3 1.49 1 281.4 3.42 3 281.5 5.81 5 281.6 9.35 9 281.7 16.6 16 281.8 30.81 30 281.9 52.23 52 282.0 75.47 75 282.1 92.78 92 282.2 100.0 99 282.3 96.62 96 282.4 81.68 81 282.5 55.62 55 282.6 25.97 25 282.7 4.39 4 //