MassBank Record: JP011867

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(2AR,5AS)-3,5-DIOXO-2,4-DIPHENYL-3,4,5,6-TETRAHYDROPYRROLO(3,4-C)PYRROLE; EI-B; MS

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

ACCESSION: JP011867
RECORD_TITLE: (2AR,5AS)-3,5-DIOXO-2,4-DIPHENYL-3,4,5,6-TETRAHYDROPYRROLO(3,4-C)PYRROLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YOSHIKI O, FAC, TECHNOLOGY, OSAKA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: (2AR,5AS)-3,5-DIOXO-2,4-DIPHENYL-3,4,5,6-TETRAHYDROPYRROLO(3,4-C)PYRROLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C18H14N2O2
CH$EXACT_MASS: 290.10552999999998746716300956904888153076171875
CH$SMILES: c(c4)ccc(c4)C(=N3)C([H])(C(=O)1)C([H])(C3)C(=O)N(c(c2)cccc2)1
CH$IUPAC: InChI=1S/C18H14N2O2/c21-17-14-11-19-16(12-7-3-1-4-8-12)15(14)18(22)20(17)13-9-5-2-6-10-13/h1-10,14-15H,11H2/t14-,15-/m1/s1
CH$LINK: INCHIKEY HLWUBVVHVMJKTP-HUUCEWRRSA-N

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-014l-9830000000-f8e87a6f2d5ed3b72673
PK$NUM_PEAK: 43
PK$PEAK: m/z int. rel.int.
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