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23,335 molecules found

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• nfdi4chem-mol42127(Unknown Molecule) Molecule

  InChIKey	YWRVUPYBXNCILR-UHFFFAOYSA-N
  Molecular Formula	C10H9N3O

  

  
  

  Related Dataset(s)

  • 2-AMINO-4PHENYLPYRIMIDINE-1-OXIDE; EI-B; MS

• nfdi4chem-mol4214 (Unknown Molecule) Molecule

  InChIKey	NTIJFRGYDKYQPV-UHFFFAOYSA-N

  

  
  

  Related Dataset(s)

  • S5-2_SODXXI_113_FULL_UPPER_SPOT_06_28_2022-CPS5-2[7]
  • S5-2_SODXXI_113_FULL_UPPER_SPOT_06_28_2022-CPS5-2[4]
  • S5-2_SODXXI_113_FULL_UPPER_SPOT_06_28_2022-CPS5-2[5]
  • S5-2_SODXXI_113_FULL_UPPER_SPOT_06_28_2022-CPS5-2[2]
  • S5-2_SODXXI_113_FULL_UPPER_SPOT_06_28_2022-CPS5-2[3]
  • S5-2_SODXXI_113_FULL_UPPER_SPOT_06_28_2022-CPS5-2[1]
  • S5-2_SODXXI_113_FULL_UPPER_SPOT_06_28_2022-CPS5-2[6]
  • S5-2_SODXXI_113_FULL_UPPER_SPOT_06_28_2022-CPS5-2[8]

• nfdi4chem-mol42152(Unknown Molecule) Molecule

  InChIKey	FOOSEGCIMSEKQV-UHFFFAOYSA-N
  Molecular Formula	C9H20OSi2

  

  
  

  Related Dataset(s)

  • ETHYL(PENTAMETHYLDISILANYL)KETENE; EI-B; MS

• nfdi4chem-mol4217 (Unknown Molecule) Molecule

  InChIKey	GJNRAOKPAMBFHT-UHFFFAOYSA-N
  Molecular Formula	C17H16N2O4

  

  
  

  Related Dataset(s)

  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • high-resolution mass spectrometry (HRMS)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • infrared absorption spectroscopy (IR)

• nfdi4chem-mol4224 (Unknown Molecule) Molecule

  InChIKey	GFNAHBQBWBEOKG-GHVJWSGMSA-N
  Molecular Formula	C20H26N4O

  

  
  

  Related Dataset(s)

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

• nfdi4chem-mol4235 (Unknown Molecule) Molecule

  InChIKey	IBTJSLBNOQOQOE-UHFFFAOYSA-N

  

  
  

  Related Dataset(s)

  • Pr-OTBDPS_DI_Bn_amide[1]
  • TBDPS acid Propyl Amine Amide[1]
  • Pr-OTBDPS_DI_Bn_amide[2]

• nfdi4chem-mol4240 (Unknown Molecule) Molecule

  InChIKey	SXMNVZGZSDKJGY-UHFFFAOYSA-N

  

  
  

  Related Dataset(s)

  • 14d[14d-H.jdx]
  • 14d[14d-C.jdx]

• nfdi4chem-mol4248 (Unknown Molecule) Molecule

  InChIKey	WYTXTCCQUJCGJW-FOCLMDBBSA-N
  Molecular Formula	C13H15FN2S2

  

  
  

  Related Dataset(s)

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

• nfdi4chem-mol4257 (Unknown Molecule) Molecule

  InChIKey	UEQZINJVZGQZAV-BEPMAALASA-N
  Molecular Formula	C6H13N5O5

  

  
  

  Related Dataset(s)

  • infrared absorption spectroscopy (IR)

• nfdi4chem-mol4268 (Unknown Molecule) Molecule

  InChIKey	GSWCLGSPFBAJHR-FBMGVBCBSA-N
  Molecular Formula	C14H24N6

  

  
  

  Related Dataset(s)

  • infrared absorption spectroscopy (IR)
  • distortionless enhancement with polarization transfer (DEPT)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • fast-atom bombardment mass spectrometry (FABMS)
  • distortionless enhancement with polarization transfer (DEPT)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)

• nfdi4chem-mol42781(Unknown Molecule) Molecule

  InChIKey	WCPJDRQPTLGHOD-JBACZVJFSA-N
  Molecular Formula	C25H34N2O7S

  

  
  

  Related Dataset(s)

  • SAR 150640; LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
  • SAR 150640; LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
  • SAR 150640; LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
  • SAR 150640; LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
  • SAR 150640; LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
  • SAR 150640; LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-

• nfdi4chem-mol4282 (Unknown Molecule) Molecule

  InChIKey	KLMGBOUPTMNAOY-AOGMVXSVSA-N

  

  
  

  Related Dataset(s)

  • compound 1[1]
  • compound 1[4]
  • compound 1[6]
  • compound 1[3]
  • compound 1[2]
  • compound 1[5]

• nfdi4chem-mol4291 (Unknown Molecule) Molecule

  InChIKey	FIIQKFWICQQMIA-QZQOTICOSA-N
  Molecular Formula	C19H18N2O2S2

  

  
  

  Related Dataset(s)

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

• nfdi4chem-mol4295 (Unknown Molecule) Molecule

  InChIKey	XLEADIRCTVGLST-UHFFFAOYSA-N

  

  
  

  Related Dataset(s)

  • Butyl Amide[2]
  • Butyl Amide[3]
  • Butyl Amide[1]
  • Butyl Amide[5]
  • Butyl Amide[4]

• nfdi4chem-mol4302 (Unknown Molecule) Molecule

  InChIKey	AXUKCSITPKIBAR-UHFFFAOYSA-N
  Molecular Formula	C25H19N2O2S

  

  
  

  Related Dataset(s)

  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • Raman spectroscopy (Raman spectrometry)
  • infrared absorption spectroscopy (IR)

• nfdi4chem-mol4317 (Unknown Molecule) Molecule

  InChIKey	SJYAMFYJLRATBC-SILNSSARSA-N
  Molecular Formula	C28H45N3

  

  
  

  Related Dataset(s)

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

• nfdi4chem-mol4333 (Unknown Molecule) Molecule

  InChIKey	RSDVJJOPRTZAOO-XUTLUUPISA-N
  Molecular Formula	C17H22N6

  

  
  

  Related Dataset(s)

  • mass spectrometry (MS)
  • infrared absorption spectroscopy (IR)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • distortionless enhancement with polarization transfer (DEPT)
  • distortionless enhancement with polarization transfer (DEPT)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)

• nfdi4chem-mol43403(Unknown Molecule) Molecule

  InChIKey	MOMFXATYAINJML-UHFFFAOYSA-N
  Molecular Formula	C5H5NOS

  

  
  

  Related Dataset(s)

  • 2-ACETYLTHIAZOLE; EI-B; MS

• nfdi4chem-mol4342 (Unknown Molecule) Molecule

  InChIKey	LTPLLZWVPBTAMH-FOCLMDBBSA-N
  Molecular Formula	C12H8Br2N2

  

  
  

  Related Dataset(s)

  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • distortionless enhancement with polarization transfer (DEPT)
  • electron ionisation mass spectrometry (EI-MS)

• nfdi4chem-mol4350 (Unknown Molecule) Molecule

  InChIKey	SNZVSILCRACJKX-CCEZHUSRSA-N
  Molecular Formula	C12H18ClN3

  

  
  

  Related Dataset(s)

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

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