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(S)-2'-(3-methylphenyl)spiro[cyclohexane-1,3'-indoline]
SpectraBase Compound ID GmHDGbjvwZF
InChI InChI=1S/C20H23N/c1-15-8-7-9-16(14-15)19-20(12-5-2-6-13-20)17-10-3-4-11-18(17)21-19/h3-4,7-11,14,19,21H,2,5-6,12-13H2,1H3/t19-/m0/s1
InChIKey VZVPWFOWWPVELO-IBGZPJMESA-N
Mol Weight 277.41 g/mol
Molecular Formula C20H23N
Exact Mass 277.18305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 81HkIL7t3oc
Name (S)-2'-(3-methylphenyl)spiro[cyclohexane-1,3'-indoline]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 277.183049745 u
Formula C20H23N
InChI InChI=1S/C20H23N/c1-15-8-7-9-16(14-15)19-20(12-5-2-6-13-20)17-10-3-4-11-18(17)21-19/h3-4,7-11,14,19,21H,2,5-6,12-13H2,1H3/t19-/m0/s1
InChIKey VZVPWFOWWPVELO-IBGZPJMESA-N
Instrument Name Finnigan MET SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201605450
Molecular Weight 277.411 g/mol
Optical Rotation [a]D22 = -108.7 (c = 1.0, MeOH)
Quality 148
SMILES N1C=2C=CC=CC2C2([C@@]1(C1=CC=CC(=C1)C)[H])CCCCC2
SPLASH splash10-00di-1890000000-c57f05057b31cdc18e14
Sample Comments 91% ee
Source of Spectrum QE-23-SM8-3n (DOI: 10.1002/chem.201605450)
Wiley ID 1903831