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(S)-2'-(4-chlorophenyl)spiro[cyclohexane-1,3'-indoline]
SpectraBase Compound ID 5hG2zn2NCYU
InChI InChI=1S/C19H20ClN/c20-15-10-8-14(9-11-15)18-19(12-4-1-5-13-19)16-6-2-3-7-17(16)21-18/h2-3,6-11,18,21H,1,4-5,12-13H2/t18-/m0/s1
InChIKey VSYDUXZUJPJSDY-SFHVURJKSA-N
Mol Weight 297.83 g/mol
Molecular Formula C19H20ClN
Exact Mass 297.128427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ZcerHFFFg
Name (S)-2'-(4-chlorophenyl)spiro[cyclohexane-1,3'-indoline]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20ClN
InChI InChI=1S/C19H20ClN/c20-15-10-8-14(9-11-15)18-19(12-4-1-5-13-19)16-6-2-3-7-17(16)21-18/h2-3,6-11,18,21H,1,4-5,12-13H2/t18-/m0/s1
InChIKey VSYDUXZUJPJSDY-SFHVURJKSA-N
Instrument Name Finnigan MET SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201605450
Molecular Weight 297.829 g/mol
Optical Rotation [a]D22 = -104.8 (c = 1.0, MeOH)
Quality 69
SMILES N1C=2C=CC=CC2C2([C@@]1(C1=CC=C(C=C1)Cl)[H])CCCCC2
SPLASH splash10-006w-0390000000-992b7759c08d20dc5185
Sample Comments 96% ee
Source of Spectrum QE-23-SM7-3l (DOI: 10.1002/chem.201605450)
Wiley ID 1903829