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2(e)-tert-Butyl-4-oxoadamantan-2(a)-ol
SpectraBase Compound ID GaFrJKwiXb1
InChI InChI=1S/C14H22O2/c1-13(2,3)14(16)10-5-8-4-9(7-10)12(15)11(14)6-8/h8-11,16H,4-7H2,1-3H3/t8-,9+,10-,11+,14?/m1/s1
InChIKey RYONSNUJNJYMCI-BEFAEFHDSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ALrxSGuZ0dm
Name 2(e)-tert-Butyl-4-oxoadamantan-2(a)-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-13(2,3)14(16)10-5-8-4-9(7-10)12(15)11(14)6-8/h8-11,16H,4-7H2,1-3H3/t8-,9+,10-,11+,14?/m1/s1
InChIKey RYONSNUJNJYMCI-BEFAEFHDSA-N
Molecular Weight 222.328 g/mol
SMILES OC1([C@@]2(C([C@@]3(C[C@]1(C[C@](C2)(C3)[H])[H])[H])=O)[H])C(C)(C)C
SPLASH splash10-014i-7900000000-21827216ebd63ea118b8
Source of Spectrum J-56-1707-30
Synonyms 4-tert-Butyl-4-hydroxy-2-adamantanone
Wiley ID 1222956