ACCESSION: MSBNK-Keio_Univ-KO003317
RECORD_TITLE: Lidocaine; LC-ESI-QQ; MS2; CE:10 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 10 V

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

PK$SPLASH: splash10-000i-0090000000-3dd6e01da50ad1a66b2f
PK$NUM_PEAK: 51
PK$PEAK: m/z int. rel.int.
  46.200 24752.5 1
  62.800 118812.0 1
  70.200 54455.5 1
  71.100 59406.0 1
  73.200 84158.5 1
  77.100 84158.5 1
  86.100 3534657.0 9
  89.100 405941.0 1
  90.400 227723.0 1
  91.300 173267.5 1
  94.900 49505.0 1
  100.300 39604.0 1
  101.300 14851.5 1
  104.200 801981.0 2
  104.900 49505.0 1
  107.000 158416.0 1
  107.700 54455.5 1
  108.300 34653.5 1
  109.300 69307.0 1
  111.300 2227725.0 6
  112.200 4767331.5 13
  113.900 54455.5 1
  114.500 19802.0 1
  118.900 69307.0 1
  121.200 2504953.0 7
  123.000 123762.5 1
  128.900 2480200.5 7
  130.100 4811886.0 13
  131.400 39604.0 1
  132.100 5688124.5 15
  137.200 128713.0 1
  144.800 108911.0 1
  147.300 34653.5 1
  149.000 9901.0 1
  152.900 108911.0 1
  155.000 44554.5 1
  158.800 306931.0 1
  161.900 19802.0 1
  175.100 2470299.5 7
  177.000 153465.5 1
  181.400 54455.5 1
  186.300 153465.5 1
  188.500 79208.0 1
  189.000 29703.0 1
  199.400 400990.5 1
  200.500 9465356.0 25
  203.200 767327.5 2
  217.400 1801982.0 5
  218.400 53024805.5 140
  235.300 377495427.0 999
  446.900 24752.5 1
//