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Mixture of (a,E)-1,10-dihydroxy-(2.2)metacyclophan and (E,E)-1,10-diydroxy-(2.2)metacyclophane
SpectraBase Compound ID IeBE1610ld1
InChI InChI=1S/C16H16O2/c17-15-8-11-3-1-4-12(7-11)9-16(18)14-6-2-5-13(15)10-14/h1-7,10,15-18H,8-9H2
InChIKey JXMRSJOCPNIPPV-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C16H16O2
Exact Mass 240.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DEes1uCL1Y0
Name Mixture of (a,E)-1,10-dihydroxy-(2.2)metacyclophan and (E,E)-1,10-diydroxy-(2.2)metacyclophane
CAS Registry Number 55894-62-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O2
InChI InChI=1S/C16H16O2/c17-15-8-11-3-1-4-12(7-11)9-16(18)14-6-2-5-13(15)10-14/h1-7,10,15-18H,8-9H2
InChIKey JXMRSJOCPNIPPV-UHFFFAOYSA-N
Molecular Weight 240.302 g/mol
SMILES OC1c2cc(C(Cc3cc(C1)ccc3)O)ccc2
SPLASH splash10-0fbc-0960000000-90fc47a38e8415504438
Source of Spectrum AH-106-198-0
Synonyms Tricyclo[9.3.1.1(4,8)]hexadeca-1(15),4,6,8(16),11,13-hexaene-2,10-diol, stereoisomer Mixture of (E,E)-1,10-dihydroxy[2.2]metacyclophane and (a,E)-1,10-dihydroxy[2.2]metacyclophane Tricyclo[9.3.1.1(4,8)]hexadeca-1(15),4(16),5,7,11,13-hexaene-2,10-diol
Wiley ID 1243454