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16-(Methoxycarbonyl)-17-hydroxy-20-methyl[14]metacyclophane
SpectraBase Compound ID HICRIoLqIPC
InChI InChI=1S/C23H36O3/c1-18-19-15-13-11-9-7-5-3-4-6-8-10-12-14-16-20(18)22(21(24)17-19)23(25)26-2/h17,24H,3-16H2,1-2H3
InChIKey KMSFUYMUFXBKOY-UHFFFAOYSA-N
Mol Weight 360.5 g/mol
Molecular Formula C23H36O3
Exact Mass 360.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AVePdj9qP5v
Name 16-(Methoxycarbonyl)-17-hydroxy-20-methyl[14]metacyclophane
CAS Registry Number 94294-22-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O3
InChI InChI=1S/C23H36O3/c1-18-19-15-13-11-9-7-5-3-4-6-8-10-12-14-16-20(18)22(21(24)17-19)23(25)26-2/h17,24H,3-16H2,1-2H3
InChIKey KMSFUYMUFXBKOY-UHFFFAOYSA-N
Molecular Weight 360.538 g/mol
SMILES Oc1c(c2c(C)c(c1)CCCCCCCCCCCCCC2)C(=O)OC
SPLASH splash10-01t9-0009000000-5a0f180cc948075c281c
Source of Spectrum J-50-457-17
Synonyms Methyl 18-hydroxy-20-methylbicyclo[14.3.1]icosa-1(20),16,18-triene-17-carboxylate
Wiley ID 1348659