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XLR11 N-(3-fluoropentyl) isomer
SpectraBase Compound ID GRX38ITDAfq
InChI InChI=1S/C21H28FNO/c1-6-14(22)11-12-23-13-16(15-9-7-8-10-17(15)23)18(24)19-20(2,3)21(19,4)5/h7-10,13-14,19H,6,11-12H2,1-5H3
InChIKey FAFWRNLRDMHCOR-UHFFFAOYSA-N
Mol Weight 329.46 g/mol
Molecular Formula C21H28FNO
Exact Mass 329.215493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcFhacBqidu
Name XLR11 N-(3-fluoropentyl) isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28FNO
InChI InChI=1S/C21H28FNO/c1-6-14(22)11-12-23-13-16(15-9-7-8-10-17(15)23)18(24)19-20(2,3)21(19,4)5/h7-10,13-14,19H,6,11-12H2,1-5H3
InChIKey FAFWRNLRDMHCOR-UHFFFAOYSA-N
Molecular Weight 329.459 g/mol
SMILES c1[n](c2ccccc2c1C(=O)C1C(C1(C)C)(C)C)CCC(CC)F
SPLASH splash10-001i-1591000000-d72303b9387f945e1d19
Source of Spectrum SWG-33-3730-0
Synonyms (1-(3-fluoropentyl)-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone
Wiley ID 1810454