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2-carbonofluoridoyl-3-phenyl-1-pyrrolo[2,1-a]isoquinolinecarboxylic acid ethyl ester
SpectraBase Compound ID JlBVthfI9o6
InChI InChI=1S/C22H16FNO3/c1-2-27-22(26)18-17(21(23)25)19(15-9-4-3-5-10-15)24-13-12-14-8-6-7-11-16(14)20(18)24/h3-13H,2H2,1H3
InChIKey RVAONIXZVJASQG-UHFFFAOYSA-N
Mol Weight 361.37 g/mol
Molecular Formula C22H16FNO3
Exact Mass 361.111422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID vbS3AeTK7P
Name 2-carbonofluoridoyl-3-phenyl-1-pyrrolo[2,1-a]isoquinolinecarboxylic acid ethyl ester
Alternate Name(s) 2-fluorocarbonyl-3-phenyl-pyrrol[2,1-a]isoquinoline-1-carboxylic acid ethyl ester ethyl 2-carbonofluoridoyl-3-phenyl-pyrrolo[2,1-a]isoquinoline-1-carboxylate ethyl 2-carbonofluoridoyl-3-phenylpyrrolo[2,1-a]isoquinoline-1-carboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16FNO3
InChI InChI=1S/C22H16FNO3/c1-2-27-22(26)18-17(21(23)25)19(15-9-4-3-5-10-15)24-13-12-14-8-6-7-11-16(14)20(18)24/h3-13H,2H2,1H3
InChIKey RVAONIXZVJASQG-UHFFFAOYSA-N
Molecular Weight 361.372 g/mol
SMILES c1-2[n](C=Cc3ccccc23)c(c(c1C(=O)OCC)C(=O)F)-c1ccccc1
SPLASH splash10-03di-0009000000-f3d05fb8e35a23004855
Source of Spectrum K-2001-3209-10
Wiley ID 1580166