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TRIPELENNAMINE; CI-B; MS

Mass Spectrum

Chemical Structure

metabolomics-usi visualisation

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003191
RECORD_TITLE: TRIPELENNAMINE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YOSHIZUMI H, FAC. OF PHARMACY, MEIJO UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: TRIPELENNAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₂₁N₃
CH$EXACT_MASS: 255.17355
CH$SMILES: CN(C)CCN(Cc(c2)cccc2)c(c1)nccc1
CH$IUPAC: InChI=1S/C16H21N3/c1-18(2)12-13-19(16-10-6-7-11-17-16)14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3
CH$LINK: INCHIKEY UFLGIAIHIAPJJC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8023717

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

PK$SPLASH: splash10-0a4i-0090000000-c34cc7c068c800fe56be
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  185 2 20
  211 5 50
  254 3 30
  255 5 50
  256 99.99 999
  257 18 180
  258 2 20
//

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Responsible: Tillmann G. Fischer

Funded by the Deutsche Forschungsgemeinschaft (DFG, German Research Foundation) under the National Research Data Infrastructure – NFDI4Chem – Projektnummer 441958208.