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23,294 molecules found

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• nfdi4chem-mol1962 (Unknown Molecule) Molecule

  InChIKey	ISSFAAFZIJMWHN-BETUJISGSA-N
  Molecular Formula	C13H18O

  

  
  

  Related Dataset(s)

  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • electron ionisation mass spectrometry (EI-MS)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)

• nfdi4chem-mol1980 (Unknown Molecule) Molecule

  InChIKey	AICMJRHSDXUONE-ZQNYTAOISA-N

  

  
  

  Related Dataset(s)

  • 11_SODXXI_046_FULL_C19_ALD_C3_C17_DI_OAC_D5_RED_08_02_2021-CP11[4]
  • 11_SODXXI_046_FULL_C19_ALD_C3_C17_DI_OAC_D5_RED_08_02_2021-CP11[1]
  • 11_SODXXI_046_FULL_C19_ALD_C3_C17_DI_OAC_D5_RED_08_02_2021-CP11[3]
  • 11_SODXXI_046_FULL_C19_ALD_C3_C17_DI_OAC_D5_RED_08_02_2021-CP11[2]
  • 11_SODXXI_046_FULL_C19_ALD_C3_C17_DI_OAC_D5_RED_08_02_2021-CP11[5]
  • 11_SODXXI_046_FULL_C19_ALD_C3_C17_DI_OAC_D5_RED_08_02_2021-CP11.hsqc
  • 11_SODXXI_046_FULL_C19_ALD_C3_C17_DI_OAC_D5_RED_08_02_2021-CP11.noesy
  • 11_SODXXI_046_FULL_C19_ALD_C3_C17_DI_OAC_D5_RED_08_02_2021-CP11.hmbc

• nfdi4chem-mol1982 (Unknown Molecule) Molecule

  InChIKey	NHXSMEATCRWYPK-ROJLCIKYSA-N
  Molecular Formula	C32H26N2O5

  

  
  

  Related Dataset(s)

  • thin-layer chromatography (TLC)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • 1H--1H correlation spectroscopy (1H-1H COSY)
  • 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
  • single crystal X-ray diffraction (single-crystal X-ray diffraction)
  • atmospheric pressure chemical ionisation mass spectrometry (APCI MS)
  • high-resolution mass spectrometry (HRMS)
  • distortionless enhancement with polarization transfer (DEPT)

• nfdi4chem-mol1984 (Unknown Molecule) Molecule

  InChIKey	HYVIXVFOOCXSPL-UHFFFAOYSA-N

  

  
  

  Related Dataset(s)

  • 9_11_NMR_Methanol-d4-1[54]
  • 9_11_NMR_Methanol-d4-1[53]
  • 9_11_NMR_Methanol-d4-1[52]
  • 9_11_NMR_Methanol-d4-1[51]
  • 9_11_NMR_Methanol-d4-2[20]
  • 9_11_NMR_Methanol-d4-2[21]
  • 9_11_NMR_Methanol-d4-1[50]

• nfdi4chem-mol1988 (Unknown Molecule) Molecule

  InChIKey	LJHXYYQLWKACLA-ACCUITESSA-N
  Molecular Formula	C10H18N4O

  

  
  

  Related Dataset(s)

  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • electron ionisation mass spectrometry (EI-MS)

• nfdi4chem-mol2005 (Unknown Molecule) Molecule

  InChIKey	XKEJIOHENQHDTH-UHFFFAOYSA-N
  Molecular Formula	C23H21N

  

  
  

  Related Dataset(s)

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

• nfdi4chem-mol2018 (Unknown Molecule) Molecule

  InChIKey	ZTDFZLVUIVPZDU-NRSQRZTFSA-N

  

  
  

  Related Dataset(s)

  • Cnicin.proton
  • Cnicin.hmbc
  • Cnicin.cosy
  • Cnicin.apt
  • Cnicin.noesy
  • Cnicin.hsqc

• nfdi4chem-mol20398(Unknown Molecule) Molecule

  InChIKey	JPFXXCHVHVZOIN-UKTHLTGXSA-N
  Molecular Formula	C12H11N

  

  
  

  Related Dataset(s)

  • N-(1-NAPHTHYLMETHYLIDENE)METHYLAMINE; EI-B; MS

• nfdi4chem-mol2042 (Unknown Molecule) Molecule

  InChIKey	TZFWPFBBUPQHOJ-CCEZHUSRSA-N
  Molecular Formula	C12H18IN3

  

  
  

  Related Dataset(s)

  • infrared absorption spectroscopy (IR)
  • electron ionisation mass spectrometry (EI-MS)
  • thin-layer chromatography (TLC)
  • infrared absorption spectroscopy (IR)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)

• nfdi4chem-mol2047 (Unknown Molecule) Molecule

  InChIKey	ISPRAZFRFDRHKK-YOPYOQPVSA-N
  Molecular Formula	C52H28N4Zn

  

  
  

  Related Dataset(s)

  • infrared absorption spectroscopy (IR)

• nfdi4chem-mol20470(Unknown Molecule) Molecule

  InChIKey	QOSSAOTZNIDXMA-UHFFFAOYSA-N
  Molecular Formula	C13H22N2

  

  
  

  Related Dataset(s)

  • DICYCLOHEXYLCARBODIIMIDE; EI-B; MS

• nfdi4chem-mol2049 (Unknown Molecule) Molecule

  InChIKey	REJFNMQVXPWSOL-UKTHLTGXSA-N
  Molecular Formula	C12H17N

  

  
  

  Related Dataset(s)

  • electron ionisation mass spectrometry (EI-MS)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)

• nfdi4chem-mol2056 (Unknown Molecule) Molecule

  InChIKey	MYNGAGFSAZSURO-TVMLIUSISA-N
  Molecular Formula	C54H46N4O8

  

  
  

  Related Dataset(s)

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

• nfdi4chem-mol2063 (Unknown Molecule) Molecule

  InChIKey	QDPCLRYAFBCOEH-CZIJMRDGSA-N
  Molecular Formula	C19H17FN2S2

  

  
  

  Related Dataset(s)

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

• nfdi4chem-mol20650(Unknown Molecule) Molecule

  InChIKey	ZKMZBAABQFUXFE-UHFFFAOYSA-N
  Molecular Formula	C15H10O4

  

  
  

  Related Dataset(s)

  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2
  • Apigeninidin; LC-ESI-QTOF; MS2

• nfdi4chem-mol2072 (Unknown Molecule) Molecule

  InChIKey	WKKIRCHZQJWBFT-QURGRASLSA-N
  Molecular Formula	C18H16N4

  

  
  

  Related Dataset(s)

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

• nfdi4chem-mol2074 (Unknown Molecule) Molecule

  InChIKey	QFYSFCFTSCMLOG-SZXTZKNNSA-N
  Molecular Formula	C56H36N6O4

  

  
  

  Related Dataset(s)

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

• nfdi4chem-mol2081 (Unknown Molecule) Molecule

  InChIKey	RADSWVOTYLGRBW-QURYMOASSA-N
  Molecular Formula	C53H36N6Ni

  

  
  

  Related Dataset(s)

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

• nfdi4chem-mol2093 (Unknown Molecule) Molecule

  InChIKey	MCMNQFPXUXKKKX-ZTRVSJDYSA-N
  Molecular Formula	C48H36N6O4

  

  
  

  Related Dataset(s)

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

• nfdi4chem-mol2120 (Unknown Molecule) Molecule

  InChIKey	KDLKNWUPOAEMBF-CWBXHPNXSA-N
  Molecular Formula	C28H32N4O6

  

  
  

  Related Dataset(s)

  • infrared absorption spectroscopy (IR)

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