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4-fluoro-CUMYL-5-fluoro-PINACA

View entire compound with spectra: 1 MS (GC)

4-fluoro-CUMYL-5-fluoro-PINACA
SpectraBase Compound ID 1SnDLkKWqgE
InChI InChI=1S/C22H25F2N3O/c1-22(2,16-10-12-17(24)13-11-16)25-21(28)20-18-8-4-5-9-19(18)27(26-20)15-7-3-6-14-23/h4-5,8-13H,3,6-7,14-15H2,1-2H3,(H,25,28)
InChIKey WAXVVLQFKMMDHR-UHFFFAOYSA-N
Mol Weight 385.46 g/mol
Molecular Formula C22H25F2N3O
Exact Mass 385.196569 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AdXgrwZRXIE
Name 4-fluoro-CUMYL-5-fluoro-PINACA
Catalog Number 26134
CAS Registry Number 163106-95-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25F2N3O
InChI InChI=1S/C22H25F2N3O/c1-22(2,16-10-12-17(24)13-11-16)25-21(28)20-18-8-4-5-9-19(18)27(26-20)15-7-3-6-14-23/h4-5,8-13H,3,6-7,14-15H2,1-2H3,(H,25,28)
InChIKey WAXVVLQFKMMDHR-UHFFFAOYSA-N
Molecular Weight 385.459 g/mol
SMILES N(C(c1n[n](c2c1cccc2)CCCCCF)=O)C(c1ccc(cc1)F)(C)C
SPLASH splash10-001i-2951000000-825fc4688973e38c53d9
Source of Spectrum CAY-2023-547-0
Wiley ID 1888507