MassBank MassBank Search Contents Download

MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005613

1-(4,5-DEHYDROTETRAHYDRO-2-FURANYL)-5-FLUOROURACIL; CI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005613
RECORD_TITLE: 1-(4,5-DEHYDROTETRAHYDRO-2-FURANYL)-5-FLUOROURACIL; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 1-(4,5-DEHYDROTETRAHYDRO-2-FURANYL)-5-FLUOROURACIL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H7FN2O3
CH$EXACT_MASS: 198.04407
CH$SMILES: [H]C(=C([H])2)CC(O2)N(C(=O)1)C([H])=C(F)C(=O)N1
CH$IUPAC: InChI=1S/C8H7FN2O3/c9-5-4-11(6-2-1-3-14-6)8(13)10-7(5)12/h1,3-4,6H,2H2,(H,10,12,13)
CH$LINK: INCHIKEY PDLPZZHYCMXDCF-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID60276289

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 ISOBUTANE

PK$SPLASH: splash10-0002-0900000000-98652421b650ca3c503b
PK$NUM_PEAK: 4
PK$PEAK: m/z int. rel.int.
  131 27 270
  171 2.2 22
  173 1.7 17
  199 99.99 999
//

system version 2.2.5
Copyright © 2006 MassBank Project; 2011 NORMAN Association; 2021 MassBank Consortium
de.NBI logo
EAWAG logo
fnr logo
IPB logo
NORMAN logo
UFZ logo
LCSB logo
HBM4EU logo
nfdi4chem logo