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(+)-13-(Hydroxymethyl)-14-hydroxy-17-benzyl[11]-metacyclophane
SpectraBase Compound ID FZOvZ3QrUtU
InChI InChI=1S/C25H34O2/c26-19-24-22-16-12-7-5-3-1-2-4-6-11-15-21(18-25(24)27)23(22)17-20-13-9-8-10-14-20/h8-10,13-14,18,26-27H,1-7,11-12,15-17,19H2
InChIKey GASZIBOEIHTTGM-UHFFFAOYSA-N
Mol Weight 366.5 g/mol
Molecular Formula C25H34O2
Exact Mass 366.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6gMj2QMP6VU
Name (+)-13-(Hydroxymethyl)-14-hydroxy-17-benzyl[11]-metacyclophane
CAS Registry Number 94294-24-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34O2
InChI InChI=1S/C25H34O2/c26-19-24-22-16-12-7-5-3-1-2-4-6-11-15-21(18-25(24)27)23(22)17-20-13-9-8-10-14-20/h8-10,13-14,18,26-27H,1-7,11-12,15-17,19H2
InChIKey GASZIBOEIHTTGM-UHFFFAOYSA-N
Molecular Weight 366.545 g/mol
SMILES OCc1c2c(c(cc1O)CCCCCCCCCCC2)Cc1ccccc1
SPLASH splash10-0udm-3009000000-4fe8625a6cb3d9837bbb
Source of Spectrum J-50-457-23
Synonyms 17-benzyl-14-(hydroxymethyl)bicyclo[11.3.1]heptadeca-1(17),13,15-trien-15-ol
Wiley ID 1352296