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(R-1S)-4-Caphanoyl-[2.2]paracyclophane
SpectraBase Compound ID Hk2mlmI3BPJ
InChI InChI=1S/C26H28O4/c1-24(2)25(3)14-15-26(24,30-22(25)27)23(28)29-21-16-19-9-8-17-4-6-18(7-5-17)10-12-20(21)13-11-19/h4-7,11,13,16H,8-10,12,14-15H2,1-3H3/t25-,26+/m0/s1
InChIKey LTYUWYDNOGPGJL-IZZNHLLZSA-N
Mol Weight 404.51 g/mol
Molecular Formula C26H28O4
Exact Mass 404.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L5IhxhqLUtp
Name (R-1S)-4-Caphanoyl-[2.2]paracyclophane
Alternate Name(s) (Sp,1S)-[2.2]paracyclophane-4-yl (1S)-(-)-camphanic acid ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H28O4
InChI InChI=1S/C26H28O4/c1-24(2)25(3)14-15-26(24,30-22(25)27)23(28)29-21-16-19-9-8-17-4-6-18(7-5-17)10-12-20(21)13-11-19/h4-7,11,13,16H,8-10,12,14-15H2,1-3H3/t25-,26+/m0/s1
InChIKey LTYUWYDNOGPGJL-IZZNHLLZSA-N
Molecular Weight 404.506 g/mol
SMILES [C@@]12(OC(=O)[C@](C2(C)C)(C)CC1)C(Oc1c2ccc(c1)CCc1ccc(CC2)cc1)=O
SPLASH splash10-0udi-0913200000-8b848cacf825d13d75d4
Source of Spectrum K1-2002-473-3
Wiley ID 1521982