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23,294 molecules found

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• nfdi4chem-mol2598 (Unknown Molecule) Molecule

  InChIKey	CSFWPUWCSPOLJW-UHFFFAOYSA-N
  Molecular Formula	C10H6O3

  

  
  

  Related Dataset(s)

  • 2-Hydroxy-1,4-naphthoquinone.c13
  • 2-Hydroxy-1,4-naphthoquinone.noesy
  • 2-Hydroxy-1,4-naphthoquinone.apt
  • 2-Hydroxy-1,4-naphthoquinone.hmbc
  • 2-Hydroxy-1,4-naphthoquinone.hsqc
  • 2-Hydroxy-1,4-naphthoquinone.cosy

• nfdi4chem-mol26038(Unknown Molecule) Molecule

  InChIKey	GWWGRYGNRKFSSX-GDNZZTSVSA-N
  Molecular Formula	C15H19NO4

  

  
  

  Related Dataset(s)

  • Convolidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
  • Convolidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
  • Convolidine; LC-ESI-QQQ; MS; [M+H]+
  • Convolidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
  • Convolidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+

• nfdi4chem-mol2608 (Unknown Molecule) Molecule

  InChIKey	KPQLWUJGTGMGMF-GHVJWSGMSA-N
  Molecular Formula	C20H13BrN2O4

  

  
  

  Related Dataset(s)

  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • mass spectrometry (MS)
  • infrared absorption spectroscopy (IR)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)

• nfdi4chem-mol2609 (Unknown Molecule) Molecule

  InChIKey	LAJSKNLWVAKBQD-UHFFFAOYSA-N
  Molecular Formula	C14H25N3O5

  

  
  

  Related Dataset(s)

  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • high-resolution mass spectrometry (HRMS)
  • 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

• nfdi4chem-mol2612 (Unknown Molecule) Molecule

  InChIKey	AIEMMDHYHQVEGS-WCWDXBQESA-N
  Molecular Formula	C22H18N2O4

  

  
  

  Related Dataset(s)

  • mass spectrometry (MS)
  • mass spectrometry (MS)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • infrared absorption spectroscopy (IR)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)

• nfdi4chem-mol26150(Unknown Molecule) Molecule

  InChIKey	FGAMQNGFFIKHJD-MCBDCWICSA-N
  Molecular Formula	C44H58O6

  

  
  

  Related Dataset(s)

  • Dehydro fucoxanthin acetate; FAB-EBEB; MS2; m/z: 682.42; [M]*+

• nfdi4chem-mol2624 (Unknown Molecule) Molecule

  InChIKey	SPVGMJGFMCEOLB-QOFCDOINSA-N

  

  
  

  Related Dataset(s)

  • CB3[4]
  • CB3[3]
  • CB3[6]
  • CB3[5]
  • CB3[2]

• nfdi4chem-mol26362(Unknown Molecule) Molecule

  InChIKey	CPAANNNWJHTNNJ-UHFFFAOYSA-N
  Molecular Formula	C11H15NSi

  

  
  

  Related Dataset(s)

  • 2-(Dimethylsilyl)-1-methyl-1H-indole; GC-EI-TOF; MS; POSITIVE; 70 V

• nfdi4chem-mol2640 (Unknown Molecule) Molecule

  InChIKey	BWIQAVJNDIBWCE-YTTGMZPUSA-N

  

  
  

  Related Dataset(s)

  • Propyl Ethyl Prefinal[1]
  • Propyl Ethyl Prefinal[4]
  • Propyl Ethyl Prefinal[2]
  • Propyl ethyl prefinal 2[1]
  • Propyl Ethyl Prefinal[3]

• nfdi4chem-mol2643 (Unknown Molecule) Molecule

  InChIKey	WDPQIRUCBOLRAB-UHFFFAOYSA-K
  Molecular Formula	C33H21EuF3N3O6

  

  
  

  Related Dataset(s)

  • infrared absorption spectroscopy (IR)

• nfdi4chem-mol2656 (Unknown Molecule) Molecule

  InChIKey	ZDUCMKTVSXLETR-FSVBIDJLSA-N

  

  
  

  Related Dataset(s)

  • Alpha-amanitin[2]

• nfdi4chem-mol26567(Unknown Molecule) Molecule

  InChIKey	FLRPGUPKHDJDQL-XLKFXECMSA-N
  Molecular Formula	C14H20O5

  

  
  

  Related Dataset(s)

  • 5-HYDROXY-3-METHOXY-2,6-DIMETHYL-(6R)-((2R)-2-METHYLBUTYRYLOXY)-2,4-CYCLOHEXADIEN-1-ONE; EI-B; MS

• nfdi4chem-mol26587(Unknown Molecule) Molecule

  InChIKey	XFDQQADEQRAUEK-RMKNXTFCSA-N
  Molecular Formula	C8H9NO

  

  
  

  Related Dataset(s)

  • N-(2-HYDROXYBENZYLIDENE)METHYLAMINE; EI-B; MS

• nfdi4chem-mol2662 (Unknown Molecule) Molecule

  InChIKey	FLPICFKQBFDOEY-OCEACIFDSA-N
  Molecular Formula	C22H16N4

  

  
  

  Related Dataset(s)

  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • infrared absorption spectroscopy (IR)
  • process
  • mass spectrometry (MS)
  • elemental analysis (EA)

• nfdi4chem-mol2664 (Unknown Molecule) Molecule

  InChIKey	FFFNFYFJWBCRPA-UHFFFAOYSA-J
  Molecular Formula	C36H32Cu4I4N2P2

  

  
  

  Related Dataset(s)

  • single crystal X-ray diffraction (single-crystal X-ray diffraction)
  • mass spectrometry (MS)

• nfdi4chem-mol2670 (Unknown Molecule) Molecule

  InChIKey	XYTFEHOVKCFNQD-UHFFFAOYSA-N

  

  
  

  Related Dataset(s)

  • 13c_JCAMP[13c_HEE301.jdx]

• nfdi4chem-mol2703 (Unknown Molecule) Molecule

  InChIKey	DGQLVPJVXFOQEV-IVUQUTFQSA-N

  

  
  

  Related Dataset(s)

  • carminic acid.cosy
  • carminic acid.1d
  • carminic acid.aptjmod
  • carminic acid.hmbc
  • carminic acid.hsqc
  • carminic acid.noesy

• nfdi4chem-mol2733 (Unknown Molecule) Molecule

  InChIKey	AMXISWHLIUERHQ-FOCLMDBBSA-N
  Molecular Formula	C13H13FN2O2S2

  

  
  

  Related Dataset(s)

  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • infrared absorption spectroscopy (IR)
  • electron ionisation mass spectrometry (EI-MS)
  • thin-layer chromatography (TLC)
  • 19F nuclear magnetic resonance spectroscopy (19F NMR)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • ultraviolet-visible spectrophotometry (UV-VIS)

• nfdi4chem-mol2734 (Unknown Molecule) Molecule

  InChIKey	LLIFZWKYANUXDS-AJIYHSCXSA-N
  Molecular Formula	C66H46N4O4

  

  
  

  Related Dataset(s)

  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • infrared absorption spectroscopy (IR)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • mass spectrometry (MS)

• nfdi4chem-mol2796 (Unknown Molecule) Molecule

  InChIKey	MANLPSFFAQQERI-UHFFFAOYSA-N
  Molecular Formula	C24H23N

  

  
  

  Related Dataset(s)

  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
  • fast-atom bombardment mass spectrometry (FABMS)
  • 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)

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