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(-)-(S,4Sp,12Sp)-4-Hydroxy-12-(4-isopropyloxazolin-2-yl)[2.2]paracyclophane
SpectraBase Compound ID FyYMiQTfpCp
InChI InChI=1S/C22H25NO2/c1-14(2)20-13-25-22(23-20)19-11-15-3-7-17(19)8-4-16-6-10-18(9-5-15)21(24)12-16/h3,6-7,10-12,14,20,24H,4-5,8-9,13H2,1-2H3/t20-/m1/s1
InChIKey SZDXJJXKGUDRFI-HXUWFJFHSA-N
Mol Weight 335.45 g/mol
Molecular Formula C22H25NO2
Exact Mass 335.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lj7UqkoW3Tf
Name (-)-(S,4Sp,12Sp)-4-Hydroxy-12-(4-isopropyloxazolin-2-yl)[2.2]paracyclophane
Alternate Name(s) (+)-(S,4Rp,12Rp)-4-Hydroxy-12-(4-isopropyloxazolin-2-yl)[2.2]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25NO2
InChI InChI=1S/C22H25NO2/c1-14(2)20-13-25-22(23-20)19-11-15-3-7-17(19)8-4-16-6-10-18(9-5-15)21(24)12-16/h3,6-7,10-12,14,20,24H,4-5,8-9,13H2,1-2H3/t20-/m1/s1
InChIKey SZDXJJXKGUDRFI-HXUWFJFHSA-N
Literature Reference DOI 10.1002/adsc.200600233
Molecular Weight 335.447 g/mol
SMILES Oc1c2CCc3cc(C=4OC[C@@](N4)(C(C)C)[H])c(CCc(c1)cc2)cc3
SPLASH splash10-014r-0196000000-2b784d992baaddff6e2c
Source of Spectrum ASC-348-2098-2a
Wiley ID 1764974