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nfdi4chem-mol8148 (Unknown Molecule) Molecule
InChIKey NKJOKOTURDLREK-UHFFFAOYSA-N Molecular Formula C22H18FN
Related Dataset(s)
- attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- fast-atom bombardment mass spectrometry (FABMS)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
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nfdi4chem-mol8238 (Unknown Molecule) Molecule
InChIKey BMBRODYQLVMXRY-UHFFFAOYSA-N Molecular Formula C35H50O2S4Si4
Related Dataset(s)
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nfdi4chem-mol8298 (Unknown Molecule) Molecule
InChIKey XZDGUUWUWKTGNG-RIYZIHGNSA-N Molecular Formula C11H9BrN2
Related Dataset(s)
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nfdi4chem-mol8384 (Unknown Molecule) Molecule
InChIKey NJUPBQDEHNKSRV-UHFFFAOYSA-N Molecular Formula C22H18N2O2
Related Dataset(s)
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nfdi4chem-mol8411 (Unknown Molecule) Molecule
InChIKey XMYRLJRPWYRZOF-RSVDOSDISA-N Molecular Formula C54H42N4O6
Related Dataset(s)
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nfdi4chem-mol8453 (Unknown Molecule) Molecule
InChIKey SSTDOKZYUWDQQQ-FBMGVBCBSA-N Molecular Formula C14H26N6O
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- infrared absorption spectroscopy (IR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- fast-atom bombardment mass spectrometry (FABMS)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
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nfdi4chem-mol8696 (Unknown Molecule) Molecule
InChIKey KYQMJVXFEUZCLO-NTEUORMPSA-N Molecular Formula C12H12N2S
Related Dataset(s)
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nfdi4chem-mol8735 (Unknown Molecule) Molecule
InChIKey GCGLJLWQDSASOX-UHFFFAOYSA-N Molecular Formula C22H12F2
Related Dataset(s)
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nfdi4chem-mol8822 (Unknown Molecule) Molecule
InChIKey QYFQNSKAHGLVQL-XRTKQMIRSA-N Molecular Formula C82H52N8Ni
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- ultraviolet-visible spectrophotometry (UV-VIS)
- infrared absorption spectroscopy (IR)
- infrared absorption spectroscopy (IR)
- mass spectrometry (MS)
- mass spectrometry (MS)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
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nfdi4chem-mol8884 (Unknown Molecule) Molecule
InChIKey FWBCIECGLUAHJU-UBRHXMOSBA-M Molecular Formula C29H30Ag2F3N10O3S+
Related Dataset(s)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- single crystal X-ray diffraction (single-crystal X-ray diffraction)
- mass spectrometry (MS)
- infrared absorption spectroscopy (IR)
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nfdi4chem-mol8891 (Unknown Molecule) Molecule
InChIKey SSFFLEQBOGAZAD-UHFFFAOYSA-N Molecular Formula C22H18FN
Related Dataset(s)
- fast-atom bombardment mass spectrometry (FABMS)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
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nfdi4chem-mol8953 (Unknown Molecule) Molecule
InChIKey GSCCFQIFSQODIH-ADDCXGJNSA-F Molecular Formula C184H180Au2F60N16O16P10Ru8
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--1H nuclear Overhauser enhancement spectroscopy (1H-1H NOESY)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- ultraviolet-visible spectrophotometry (UV-VIS)
- 1H-1H only para-hydrogen spectroscopy correlation spectroscopy (1H-1H OPSY-COSY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- desorption electrospray ionisation mass spectrometry (DESIMS)
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nfdi4chem-mol9064 (Unknown Molecule) Molecule
InChIKey MHXCDLXKIQSKSW-WNLPKAFNSA-N Molecular Formula C51H43CuN2OP2
Related Dataset(s)
- fast-atom bombardment mass spectrometry (FABMS)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- X-ray diffraction (XRD)
- proton-decoupled 31P nuclear magnetic resonance spectroscopy (31P{1H}-NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
- elemental analysis (EA)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
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nfdi4chem-mol9148 (Unknown Molecule) Molecule
InChIKey QJQNAICAFONOJF-WNLPKAFNSA-N Molecular Formula C48H39CuN2OP2
Related Dataset(s)
- elemental analysis (EA)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- X-ray diffraction (XRD)
- fast-atom bombardment mass spectrometry (FABMS)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
- proton-decoupled 31P nuclear magnetic resonance spectroscopy (31P{1H}-NMR)
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nfdi4chem-mol9304 (Unknown Molecule) Molecule
InChIKey CPPJLXFXHYCGON-UDSYGATOSA-N Molecular Formula C36H20N4Zn
Related Dataset(s)
- X-ray diffraction (XRD)
- ultraviolet-visible spectrophotometry (UV-VIS)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- infrared absorption spectroscopy (IR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- electrospray ionisation quadrupole detection (ESI Q Trap)
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nfdi4chem-mol9556 (Unknown Molecule) Molecule
InChIKey CANKPKUOEXKNBY-UHFFFAOYSA-N Molecular Formula C74H44N4O2
Related Dataset(s)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- ultraviolet-visible spectrophotometry (UV-VIS)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- mass spectrometry (MS)
- infrared absorption spectroscopy (IR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
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nfdi4chem-mol9995 (Unknown Molecule) Molecule
InChIKey GZXDXORFZUUVGU-XUTLUUPISA-N Molecular Formula C17H30N6O
Related Dataset(s)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 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)
- infrared absorption spectroscopy (IR)
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pentanoic acid Molecule
InChIKey NQPDZGIKBAWPEJ-UHFFFAOYSA-N Molecular Formula C5H10O2
Related Dataset(s)
- Pentanoic acid; LC-ESI-QQ; MS2; CE:30 V; [M-H]-
- VALERIC ACID; EI-B; MS
- Pentanoic acid; LC-ESI-QQ; MS2; CE:50 V; [M-H]-
- Pentanoic acid; LC-ESI-IT; MS2; m/z: 101.2; [M-H]-
- VALERIC ACID; EI-B; MS
- 1H--1H correlation spectroscopy (1H-1H COSY)
- Propylacetic acid, 1-Butanecarboxylic acid, Valerate, Valerianic acid, Carboxylic Acid C5, n-Valeric acid, Pentanoic acid, Pentanoate, Pentane Acid; LC-ESI-QQ; MS2
- Pentanoic acid; LC-ESI-QQ; MS2; CE:40 V; [M-H]-
- Pentanoic acid; LC-ESI-QQ; MS2; CE:10 V; [M-H]-
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- Pentanoic acid; LC-ESI-QQ; MS2; CE:20 V; [M-H]-
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- Propylacetic acid, 1-Butanecarboxylic acid, Valerate, Valerianic acid, Carboxylic Acid C5, n-Valeric acid, Pentanoic acid, Pentanoate, Pentane Acid; LC-ESI-QQ; MS2
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
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pentylsulfonylbenzene Molecule
InChIKey YTGRXDYSNRZUEE-UHFFFAOYSA-N Molecular Formula C11H16O2S
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- electron ionisation mass spectrometry (EI-MS)
- high-resolution mass spectrometry (HRMS)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
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potassium bis(2-methylphenyl)-dithiophen-2-ylboranuide Molecule
InChIKey LPAVHVNFCXQWAG-UHFFFAOYSA-N Molecular Formula C22H20BKS2
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
