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BB-22 pentafluorpropil analogue
SpectraBase Compound ID COfFhUHOKJZ
InChI InChI=1S/C19H20F5NO2/c20-18(21,19(22,23)24)12-27-17(26)15-11-25(10-13-6-2-1-3-7-13)16-9-5-4-8-14(15)16/h4-5,8-9,11,13H,1-3,6-7,10,12H2
InChIKey SCSDQAXERQPNRL-UHFFFAOYSA-N
Mol Weight 389.37 g/mol
Molecular Formula C19H20F5NO2
Exact Mass 389.14142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BDFQ3zSczB4
Name BB-22 pentafluorpropil analogue
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20F5NO2
InChI InChI=1S/C19H20F5NO2/c20-18(21,19(22,23)24)12-27-17(26)15-11-25(10-13-6-2-1-3-7-13)16-9-5-4-8-14(15)16/h4-5,8-9,11,13H,1-3,6-7,10,12H2
InChIKey SCSDQAXERQPNRL-UHFFFAOYSA-N
Molecular Weight 389.366 g/mol
SMILES c1[n](c2ccccc2c1C(=O)OCC(C(F)(F)F)(F)F)CC1CCCCC1
SPLASH splash10-0a4i-3918000000-c33389c820d5fe249434
Source of Spectrum SWG-33-4000-0
Synonyms 2,2,3,3,3-pentafluoropropyl-1-(cyclohexylmethyl)-1H-indole-3-carboxylate 2,2,3,3,3-pentafluoropropyl 1-(cyclohexylmethyl)-1H-indole-3-carboxylate
Wiley ID 1810658