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cis-2,3-Di-(1-adamantyl)-14-crown-4
SpectraBase Compound ID EXQGtNIWzmM
InChI InChI=1S/C30H48O4/c1-3-31-7-8-32-4-2-6-34-28(30-18-24-12-25(19-30)14-26(13-24)20-30)27(33-5-1)29-15-21-9-22(16-29)11-23(10-21)17-29/h21-28H,1-20H2/t21-,22+,23-,24?,25?,26?,27-,28+,29-,30?/m0/s1
InChIKey UHODEPWRGXOXMA-FOECQWGYSA-N
Mol Weight 472.7 g/mol
Molecular Formula C30H48O4
Exact Mass 472.35526 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2xL4myB0Gu
Name cis-2,3-Di-(1-adamantyl)-14-crown-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H48O4
InChI InChI=1S/C30H48O4/c1-3-31-7-8-32-4-2-6-34-28(30-18-24-12-25(19-30)14-26(13-24)20-30)27(33-5-1)29-15-21-9-22(16-29)11-23(10-21)17-29/h21-28H,1-20H2/t21-,22+,23-,24?,25?,26?,27-,28+,29-,30?/m0/s1
InChIKey UHODEPWRGXOXMA-FOECQWGYSA-N
Molecular Weight 472.710 g/mol
SMILES C12([C@]3([C@@](C45C[C@]6(C[C@@](C5)(C[C@@](C4)(C6)[H])[H])[H])(OCCCOCCOCCCO3)[H])[H])CC3CC(C2)CC(C1)C3
SPLASH splash10-0079-0900000000-d4d673c9ca1ca5c6f1b7
Source of Spectrum KC-0-492-7
Synonyms (2R,3S)-2,3-di(1-adamantyl)-1,4,8,11-tetraoxacyclotetradecane
Wiley ID 824384