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(S)-2'-(3-fluorophenyl)spiro[cyclohexane-1,3'-indoline]
SpectraBase Compound ID 6KZ4tHXYQxd
InChI InChI=1S/C19H20FN/c20-15-8-6-7-14(13-15)18-19(11-4-1-5-12-19)16-9-2-3-10-17(16)21-18/h2-3,6-10,13,18,21H,1,4-5,11-12H2/t18-/m0/s1
InChIKey HEGBYJRPARGQJA-SFHVURJKSA-N
Mol Weight 281.37 g/mol
Molecular Formula C19H20FN
Exact Mass 281.157978 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6igrFY2ofgj
Name (S)-2'-(3-fluorophenyl)spiro[cyclohexane-1,3'-indoline]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 281.157977811 u
Formula C19H20FN
InChI InChI=1S/C19H20FN/c20-15-8-6-7-14(13-15)18-19(11-4-1-5-12-19)16-9-2-3-10-17(16)21-18/h2-3,6-10,13,18,21H,1,4-5,11-12H2/t18-/m0/s1
InChIKey HEGBYJRPARGQJA-SFHVURJKSA-N
Instrument Name Finnigan MET SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201605450
Molecular Weight 281.374 g/mol
Optical Rotation [a]D22 = -113.9 (c = 1.0, MeOH)
Quality 182
SMILES N1C=2C=CC=CC2C2([C@@]1(C1=CC=CC(=C1)F)[H])CCCCC2
SPLASH splash10-00e9-1690000000-5097b25479fb510d84ff
Sample Comments 96% ee
Source of Spectrum QE-23-SM9-3p (DOI: 10.1002/chem.201605450)
Wiley ID 1903833