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5-fluoro 7-APAICA
SpectraBase Compound ID 18ajKtkc2IH
InChI InChI=1S/C23H30FN3O/c24-6-2-1-3-8-27-15-20(19-5-4-7-25-21(19)27)22(28)26-23-12-16-9-17(13-23)11-18(10-16)14-23/h4-5,7,15-18H,1-3,6,8-14H2,(H,26,28)/t16-,17+,18-,23-
InChIKey JYMCNFJJLBFSGH-BRGRSMLUSA-N
Mol Weight 383.51 g/mol
Molecular Formula C23H30FN3O
Exact Mass 383.237291 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 8R8HTOmzGl5
Name 5-Fluoro 7-APAICA
Source of Sample Cayman Chemical Company
Catalog Number 23021
Lot Number 0527042-2
Cell Type Capillary tube
Compound Type Pure
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Formula C23H30FN3O
IUPAC Name N-((3s,5s,7s)-Adamantan-1-yl)-1-(5-fluoropentyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
InChI InChI=1S/C23H30FN3O/c24-6-2-1-3-8-27-15-20(19-5-4-7-25-21(19)27)22(28)26-23-12-16-9-17(13-23)11-18(10-16)14-23/h4-5,7,15-18H,1-3,6,8-14H2,(H,26,28)/t16-,17+,18-,23-
InChIKey JYMCNFJJLBFSGH-BRGRSMLUSA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 1299 mW
Raman Laser Source Nd:YAG
SMILES N(C(c1c2cccnc2[n](c1)CCCCCF)=O)[C@@]12C[C@@]3(C[C@@](C[C@@](C3)(C1)[H])(C2)[H])[H]
Scans Performed 2112
Source of Spectrum Forensic Spectral Research
Synonyms 5-Fluoro AKB48-7N
Technique FT-Raman