ACCESSION: MSBNK-Keio_Univ-KO003318
RECORD_TITLE: Lidocaine; LC-ESI-QQ; MS2; CE:20 V; [M+H]+
DATE: 2016.01.19 (Created 2007.07.07, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID L034

CH$NAME: Lidocaine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₂₂N₂O
CH$EXACT_MASS: 234.17321
CH$SMILES: CCN(CC)CC(=O)Nc(c(C)1)c(C)ccc1
CH$IUPAC: InChI=1S/C14H22N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17)
CH$LINK: KEGG C07073
CH$LINK: INCHIKEY NNJVILVZKWQKPM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1045166

AC$INSTRUMENT: API3000, Applied Biosystems
AC$INSTRUMENT_TYPE: LC-ESI-QQ
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20 V

MS$FOCUSED_ION: PRECURSOR_M/Z 235
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+

PK$SPLASH: splash10-000i-9230000000-577ea8a290877187b518
PK$NUM_PEAK: 58
PK$PEAK: m/z int. rel.int.
  39.000 94059.5 1
  43.100 54455.5 1
  46.200 79208.0 1
  55.300 64356.5 1
  56.800 79208.0 1
  57.100 198020.0 2
  63.200 628713.5 5
  69.200 3009904.0 24
  69.900 1945546.5 16
  71.100 1455447.0 12
  72.000 871288.0 7
  73.100 470297.5 4
  74.000 212871.5 2
  77.000 445545.0 4
  78.900 54455.5 1
  82.900 128713.0 1
  84.400 79208.0 1
  85.300 420792.5 3
  86.200 125336759.0 999
  87.200 108911.0 1
  89.000 1712873.0 14
  90.100 1128714.0 9
  92.700 54455.5 1
  99.300 103960.5 1
  100.200 54455.5 1
  104.200 544555.0 4
  105.300 54455.5 1
  107.100 49505.0 1
  108.800 39604.0 1
  111.200 9712881.0 77
  112.300 19797049.5 158
  114.200 495050.0 4
  115.300 99010.0 1
  121.200 425743.0 3
  123.200 118812.0 1
  128.900 2638616.5 21
  130.100 4232677.5 34
  132.100 3094062.5 25
  133.100 69307.0 1
  143.000 29703.0 1
  147.200 29703.0 1
  156.300 24752.5 1
  157.200 44554.5 1
  157.800 29703.0 1
  164.700 29703.0 1
  169.200 29703.0 1
  170.700 14851.5 1
  172.400 14851.5 1
  174.200 34653.5 1
  175.000 267327.0 2
  176.600 19802.0 1
  199.500 89109.0 1
  200.300 1222773.5 10
  202.100 39604.0 1
  203.600 183168.5 1
  217.500 59406.0 1
  218.300 554456.0 4
  235.300 49455495.0 394
//