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5-fluoro 7-QUPAIC

View entire compound with spectra: 3 FTIR, 1 Raman, and 1 MS (GC)

5-fluoro 7-QUPAIC
SpectraBase Compound ID LKGAets01z3
InChI InChI=1S/C22H20FN3O2/c23-11-2-1-3-14-26-15-18(17-9-6-13-25-21(17)26)22(27)28-19-10-4-7-16-8-5-12-24-20(16)19/h4-10,12-13,15H,1-3,11,14H2
InChIKey CUGIQDZEJKPBDW-UHFFFAOYSA-N
Mol Weight 377.42 g/mol
Molecular Formula C22H20FN3O2
Exact Mass 377.153955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6X8C5mD2U6L
Name 5-fluoro 7-QUPAIC
Catalog Number 23011
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20FN3O2
InChI InChI=1S/C22H20FN3O2/c23-11-2-1-3-14-26-15-18(17-9-6-13-25-21(17)26)22(27)28-19-10-4-7-16-8-5-12-24-20(16)19/h4-10,12-13,15H,1-3,11,14H2
InChIKey CUGIQDZEJKPBDW-UHFFFAOYSA-N
Molecular Weight 377.419 g/mol
SMILES c12c(c[n](c2nccc1)CCCCCF)C(=O)Oc1c2c(ccc1)cccn2
SPLASH splash10-001i-2890000000-67d6012b89069bdb9e9a
Source of Spectrum CAY-2023-638-0
Wiley ID 1888597