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23,345 molecules found

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• methyl 4-[benzyl-[2-tri(propan-2-yl)silylethynyl]sulfamoyl]benzoate Molecule

  InChIKey	UZJSHZBZRWZFSF-UHFFFAOYSA-N
  Molecular Formula	C26H35NO4SSi

  

  
  

  Related Dataset(s)

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

• methyl 4-acetamido-2-ethoxybenzoate Molecule

  InChIKey	GOVWOKSKFSBNGD-UHFFFAOYSA-N
  Molecular Formula	C12H15NO4

  

  
  

  Related Dataset(s)

  • Ethopabate; LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M-H]-
  • Ethopabate; LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M-H]-
  • Ethopabate; LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M-H]-
  • Ethopabate; LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
  • Ethopabate; LC-ESI-QTOF; MS2; CE: Ramp 19.4-29.1 eV; R=35000; [M+H]+
  • Ethopabate; LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
  • Ethopabate; LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M-H]-
  • Ethopabate; LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
  • Ethopabate; LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M-H]-
  • Ethopabate; LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
  • Ethopabate; LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+

• methyl 4-acetamidobenzoate Molecule

  InChIKey	QKWTXJSLAZKYGV-UHFFFAOYSA-N
  Molecular Formula	C10H11NO3

  

  
  

  Related Dataset(s)

  • METHYL 4-ACETYLAMINOBENZOATE; CI-B; MS
  • METHYL 4-ACETYLAMINOBENZOATE; EI-B; MS

• methyl 4-acetyloxybenzoate Molecule

  InChIKey	PGJQPLVEUVHSFQ-UHFFFAOYSA-N
  Molecular Formula	C10H10O4

  

  
  

  Related Dataset(s)

  • PARA-ACETOXYBENZOIC ACID METHYL ESTER; EI-B; MS

• methyl 4-amino-2,5-difluorobenzoate Molecule

  InChIKey	WFHMJOPCOWABHH-UHFFFAOYSA-N
  Molecular Formula	C8H7F2NO2

  

  
  

  Related Dataset(s)

  • correlation spectroscopy (COSY)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • 19F nuclear magnetic resonance spectroscopy (19F NMR)
  • distortionless enhancement with polarization transfer (DEPT)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • distortionless enhancement with polarization transfer (DEPT)
  • heteronuclear multiple bond coherence (HMBC)
  • heteronuclear single quantum coherence (HSQC)

• methyl 4-amino-2-hydroxybenzoate Molecule

  InChIKey	QQOXBFUTRLDXDP-UHFFFAOYSA-N
  Molecular Formula	C8H9NO3

  

  
  

  Related Dataset(s)

  • METHYL P-AMINOSALICYLATE; EI-B; MS

• methyl 4-aminobenzoate Molecule

  InChIKey	LZXXNPOYQCLXRS-UHFFFAOYSA-N
  Molecular Formula	C8H9NO2

  

  
  

  Related Dataset(s)

  • METHYL P-AMINOBENZOATE; EI-B; MS
  • infrared absorption spectroscopy (IR)
  • METHYL PARA AMINO BENZOATE; EI-B; MS

• methyl 4-aminobutanoate Molecule

  InChIKey	KVQGGLZHHFGHPU-UHFFFAOYSA-N
  Molecular Formula	C5H11NO2

  

  
  

  Related Dataset(s)

  • METHYL4-AMINOBUTYRATE; LC-ESI-QTOF; MS2; CE: 10eV; R=5000; [M+H]+
  • METHYL4-AMINOBUTYRATE; LC-ESI-QTOF; MS2; CE: 40eV; R=5000; [M+H]+
  • METHYL4-AMINOBUTYRATE; LC-ESI-QTOF; MS2; CE: 20eV; R=5000; [M+H]+

• methyl 4-bromo-3,5-dimethoxybenzoate Molecule

  InChIKey	DBPNSECLVZPWET-UHFFFAOYSA-N
  Molecular Formula	C10H11BrO4

  

  
  

  Related Dataset(s)

  • 1H--1H correlation spectroscopy (1H-1H COSY)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
  • distortionless enhancement with polarization transfer (DEPT)
  • distortionless enhancement with polarization transfer (DEPT)
  • 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

• methyl 4-butoxybenzoate Molecule

  InChIKey	PUHCYTHGLBCWEA-UHFFFAOYSA-N
  Molecular Formula	C12H16O3

  

  
  

  Related Dataset(s)

  • 4-BUTOXYBENZOIC ACID METHYL ESTER; EI-B; MS

• methyl 4-butylbenzoate Molecule

  InChIKey	XJRYQLPELPLPHZ-UHFFFAOYSA-N
  Molecular Formula	C12H16O2

  

  
  

  Related Dataset(s)

  • 4-N-BUTYLBENZOIC ACID METHYL ESTER; EI-B; MS

• methyl 4-carbamoyl-2-iodobenzoate Molecule

  InChIKey	YYPUICOMUKAJFK-UHFFFAOYSA-N
  Molecular Formula	C9H8INO3

  

  
  

  Related Dataset(s)

  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • high-resolution electrospray ionisation mass spectrometry (HRESIMS)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)

• methyl 4-chloro-3-nitrobenzoate Molecule

  InChIKey	XRTKWPWDSUNLHS-UHFFFAOYSA-N
  Molecular Formula	C8H6ClNO4

  

  
  

  Related Dataset(s)

  • 4-CHLORO-3-NITROBENZOIC ACID METHYL ESTER; EI-B; MS

• methyl 4-chloro-4-oxobutanoate Molecule

  InChIKey	SRXOJMOGPYFZKC-UHFFFAOYSA-N
  Molecular Formula	C5H7ClO3

  

  
  

  Related Dataset(s)

  • 3-CARBOMETHOXYPROPIONYL CHLORIDE; EI-B; MS

• methyl 4-chlorobenzoate Molecule

  InChIKey	LXNFVVDCCWUUKC-UHFFFAOYSA-N
  Molecular Formula	C8H7ClO2

  

  
  

  Related Dataset(s)

  • 4-CHLOROBENZOIC ACID METHYL ESTER; EI-B; MS

• methyl 4-chlorobutanoate Molecule

  InChIKey	ZZUYIRISBMWFMV-UHFFFAOYSA-N
  Molecular Formula	C5H9ClO2

  

  
  

  Related Dataset(s)

  • GAMMA-CHLORO-N-BUTYRIC ACID METHYL ESTER; EI-B; MS

• methyl 4-cyano-2-(5-hydroxypent-1-ynyl)benzoate Molecule

  InChIKey	ICQAWZGUDLLHHP-UHFFFAOYSA-N
  Molecular Formula	C14H13NO3

  

  
  

  Related Dataset(s)

  • high-resolution electrospray ionisation mass spectrometry (HRESIMS)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)

• methyl 4-cyano-2-iodobenzoate Molecule

  InChIKey	BXYAANQVTNCINX-UHFFFAOYSA-N
  Molecular Formula	C9H6INO2

  

  
  

  Related Dataset(s)

  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • high-resolution electrospray ionisation mass spectrometry (HRESIMS)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)

• methyl 4-dimethoxyphosphorylbenzoate Molecule

  InChIKey	QJGWDEWFFPKFQG-UHFFFAOYSA-N
  Molecular Formula	C10H13O5P

  

  
  

  Related Dataset(s)

  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • heteronuclear single quantum coherence (HSQC)
  • 31P nuclear magnetic resonance spectroscopy (31P NMR)
  • electron ionisation mass spectrometry (EI-MS)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • infrared absorption spectroscopy (IR)

• methyl 4-ethoxy-2-[3-(4-ethoxy-5-methoxycarbonyl-1,3-thiazol-2-yl)phenyl]-1,3... Molecule

  InChIKey	OMBVCHPBXKBKBC-UHFFFAOYSA-N
  Molecular Formula	C20H20N2O6S2

  

  
  

  Related Dataset(s)

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

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