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23,340 molecules found

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• methyl 5-acetyloxy-7-methyl-4-oxochromene-2-carboxylate Molecule

  InChIKey	BSICPVUKEZXNLC-UHFFFAOYSA-N
  Molecular Formula	C14H12O6

  

  
  

  Related Dataset(s)

  • infrared absorption spectroscopy (IR)

• methyl 5-benzyl-14-oxo-8,13-dioxa-3,4,5-triazatetracyclo[10.8.0.02,6.015,20]i... Molecule

  InChIKey	BFIWUVQLDZLHQK-UHFFFAOYSA-N
  Molecular Formula	C24H21N3O5

  

  
  

  Related Dataset(s)

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

• methyl 5-chloro-2-nitrobenzoate Molecule

  InChIKey	JGBJHRKCUKTQOE-UHFFFAOYSA-N
  Molecular Formula	C8H6ClNO4

  

  
  

  Related Dataset(s)

  • 5-CHLORO-2-NITROBENZOIC ACID METHYL ESTER; EI-B; MS

• methyl 5-chloro-5-oxopentanoate Molecule

  InChIKey	JCAZSWWHFJVFPP-UHFFFAOYSA-N
  Molecular Formula	C6H9ClO3

  

  
  

  Related Dataset(s)

  • Methyl glutaryl chloride, Methyl 5-chloro-5-oxovalerate, methyl 5-chloro-5-oxopentanoate, Carbomethoxybutyryl Chloride, Glutaric acid monomethyl ester chloride, Methyl 4-(chloroformyl)butyrate, methyl 5-chloro-5-oxovalerate; LC-ESI-QTOF; MS2
  • Methyl 5-chloro-5-oxovalerate; LC-ESI-QTOF; MS2; CE:30 V; [M-H]-
  • Methyl 5-chloro-5-oxovalerate; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
  • Methyl glutaryl chloride, Methyl 5-chloro-5-oxovalerate, methyl 5-chloro-5-oxopentanoate, Carbomethoxybutyryl Chloride, Glutaric acid monomethyl ester chloride, Methyl 4-(chloroformyl)butyrate, methyl 5-chloro-5-oxovalerate; LC-ESI-QTOF; MS2

• methyl 5-chloropyrazine-2-carboxylate Molecule

  InChIKey	CVVMLRFXZPKILB-UHFFFAOYSA-N
  Molecular Formula	C6H5ClN2O2

  

  
  

  Related Dataset(s)

  • METHYL 5-CHLORO-2-PYRAZINECARBOXYLATE; EI-B; MS

• methyl 5-diethoxyphosphoryl-2-hydroxy-4-oxopentanoate Molecule

  InChIKey	PUNMCCFNGLRFTH-UHFFFAOYSA-N
  Molecular Formula	C10H19O7P

  

  
  

  Related Dataset(s)

  • 1-DIETHOXYPHOSPHORYL-4-HYDROXY-4-METHOXYCARBONYLBUTAN-2-ONE; EI-B; MS

• methyl 5-ethylidene-4-[2-oxo-2-[[3,4,5-trihydroxy-6-[4-(3-hydroxyprop-1-enyl)... Molecule

  InChIKey	UUUCHDSMSNBEBE-UHFFFAOYSA-N
  Molecular Formula	C34H46O19

  

  
  

  Related Dataset(s)

  • UNPD203664 (not validated); LC-ESI-QTOF; MS2

• methyl 5-ethynylpyridine-2-carboxylate Molecule

  InChIKey	PGYCVRHIHIYNBF-UHFFFAOYSA-N
  Molecular Formula	C9H7NO2

  

  
  

  Related Dataset(s)

  • METHYL 5-ETHYNYLPYRIDINE-2-CARBOXYLATE; EI-B; MS
  • METHYL 5-ETHYNYLPYRIDINE-2-CARBOXYLATE; EI-B; MS

• methyl 5-hydroxy-2-nitrobenzoate Molecule

  InChIKey	VYLLCOXNYMTKMD-UHFFFAOYSA-N
  Molecular Formula	C8H7NO5

  

  
  

  Related Dataset(s)

  • infrared absorption spectroscopy (IR)

• methyl 5-methoxy-2-nitrobenzoate Molecule

  InChIKey	UAPJKEJWOPOJJY-UHFFFAOYSA-N
  Molecular Formula	C9H9NO5

  

  
  

  Related Dataset(s)

  • infrared absorption spectroscopy (IR)

• methyl 5-methoxy-7-methyl-8-(4-methylphenyl)-4-oxo-2-(5-oxooxolan-2-yl)-3H-ch... Molecule

  InChIKey	QVZNKTRSMJDUSI-UHFFFAOYSA-N
  Molecular Formula	C24H24O7

  

  
  

  Related Dataset(s)

  • infrared absorption spectroscopy (IR)

• methyl 5-methoxy-8-(4-methoxycarbonylphenyl)-7-methyl-4-oxo-2-(5-oxooxolan-2-... Molecule

  InChIKey	WMWPZPCQGRTJNK-UHFFFAOYSA-N
  Molecular Formula	C25H24O9

  

  
  

  Related Dataset(s)

  • infrared absorption spectroscopy (IR)

• methyl 5-methyl-3-oxohex-4-enoate Molecule

  InChIKey	BRUOTCVCYPVYPM-UHFFFAOYSA-N
  Molecular Formula	C8H12O3

  

  
  

  Related Dataset(s)

  • METHYL 5-METHYL-3-KETO-4-HEXENOATE; EI-B; MS

• methyl 5-methylsulfanyl-3-oxopentanoate Molecule

  InChIKey	BUQCLWBTCPWQHB-UHFFFAOYSA-N
  Molecular Formula	C7H12O3S

  

  
  

  Related Dataset(s)

  • METHYL 5-METHYLTHIO-3-OXOPENTANOATE; EI-B; MS

• methyl 5-methylthiophene-2-sulfonate Molecule

  InChIKey	DMKKCMMNNCZHET-UHFFFAOYSA-N
  Molecular Formula	C6H8O3S2

  

  
  

  Related Dataset(s)

  • attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • mass spectrometry (MS)

• methyl 5-nitroquinoline-4-carboxylate Molecule

  InChIKey	BWQWYEQPIJBZER-UHFFFAOYSA-N
  Molecular Formula	C11H8N2O4

  

  
  

  Related Dataset(s)

  • attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)

• methyl 5-oxo-5-phenylpentanoate Molecule

  InChIKey	GRIWFUFDJOESIC-UHFFFAOYSA-N
  Molecular Formula	C12H14O3

  

  
  

  Related Dataset(s)

  • METHYL 5-KETO-5-PHENYLPENTANOATE; EI-B; MS

• methyl 5-oxohexanoate Molecule

  InChIKey	AVVPOKSKJSJVIX-UHFFFAOYSA-N
  Molecular Formula	C7H12O3

  

  
  

  Related Dataset(s)

  • 5-OXOCAPROIC ACID METHYU ESTER; EI-B; MS

• methyl 5-oxopyrrolidine-2-carboxylate Molecule

  InChIKey	HQGPKMSGXAUKHT-UHFFFAOYSA-N
  Molecular Formula	C6H9NO3

  

  
  

  Related Dataset(s)

  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 140 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 10 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 40 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 120 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 100 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 20 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 130 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 50 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 60 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 70 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 90 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 80 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 40 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 110 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 30 V
  • Methyl-5-oxopyrrolidine-2-carboxylate; LC-ESI-QTOF; MS2; 150 V

• methyl 6',7'-dimethoxy-1-methyl-2'-oxospiro[1,4a,5,5a,7,8,10,10a-octahydropyr... Molecule

  InChIKey	TTZWEOINXHJHCY-UHFFFAOYSA-N
  Molecular Formula	C23H28N2O6

  

  
  

  Related Dataset(s)

  • Isomajdine; LC-ESI-QTOF; MS2
  • Isomajdine; LC-ESI-QTOF; MS2
  • Isomajdine; LC-ESI-QTOF; MS2
  • Isomajdine; LC-ESI-QTOF; MS2
  • Isomajdine; LC-ESI-QTOF; MS2
  • Isomajdine; LC-ESI-QTOF; MS2
  • Isomajdine; LC-ESI-QTOF; MS2
  • Isomajdine; LC-ESI-QTOF; MS2
  • Isomajdine; LC-ESI-QTOF; MS2
  • Isomajdine; LC-ESI-QTOF; MS2
  • Isomajdine; LC-ESI-QTOF; MS2
  • Isomajdine; LC-ESI-QTOF; MS2
  • Isomajdine; LC-ESI-QTOF; MS2
  • Isomajdine; LC-ESI-QTOF; MS2

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