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1-adamantyl-n-butyl ether

View entire compound with spectra: 1 MS (GC)

1-adamantyl-n-butyl ether
SpectraBase Compound ID 8AlunJDW2Z3
InChI InChI=1S/C28H46O/c1(5-27-15-21-9-22(16-27)11-23(10-21)17-27)3-7-29-8-4-2-6-28-18-24-12-25(19-28)14-26(13-24)20-28/h21-26H,1-20H2/t21-,22+,23-,24-,25+,26-,27+,28+
InChIKey WFUORMOCCNMUHZ-UHFFFAOYSA-N
Mol Weight 398.7 g/mol
Molecular Formula C28H46O
Exact Mass 398.354866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3C7uDbNAYa
Name 1-adamantyl-n-butyl ether
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H46O
InChI InChI=1S/C28H46O/c1(5-27-15-21-9-22(16-27)11-23(10-21)17-27)3-7-29-8-4-2-6-28-18-24-12-25(19-28)14-26(13-24)20-28/h21-26H,1-20H2/t21-,22+,23-,24-,25+,26-,27+,28+
InChIKey WFUORMOCCNMUHZ-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 398.675 g/mol
SMILES C(OCCCCC12C[C@]3(C[C@@](C2)(C[C@](C3)(C1)[H])[H])[H])CCCC12C[C@]3(C[C@@](C2)(C[C@](C3)(C1)[H])[H])[H]
SPLASH splash10-0f72-9810000000-d2cf21cd8ea4d75666ce
Source of Spectrum JP2016160224A
Wiley ID 1853031