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4a(2H)-Naphthalenol, 2-(1,1-dimethylethyl)octahydro-, acetate, (2.alpha.,4a.alpha.,8a.beta.)-
SpectraBase Compound ID FCPD35xHwIS
InChI InChI=1S/C16H28O2/c1-12(17)18-16-9-6-5-7-14(16)11-13(8-10-16)15(2,3)4/h13-14H,5-11H2,1-4H3/t13-,14-,16+/m1/s1
InChIKey XWVCJMWCNQOLSO-FMKPAKJESA-N
Mol Weight 252.4 g/mol
Molecular Formula C16H28O2
Exact Mass 252.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1O3BiurOJMt
Name 4a(2H)-Naphthalenol, 2-(1,1-dimethylethyl)octahydro-, acetate, (2.alpha.,4a.alpha.,8a.beta.)-
CAS Registry Number 69007-53-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O2
InChI InChI=1S/C16H28O2/c1-12(17)18-16-9-6-5-7-14(16)11-13(8-10-16)15(2,3)4/h13-14H,5-11H2,1-4H3/t13-,14-,16+/m1/s1
InChIKey XWVCJMWCNQOLSO-FMKPAKJESA-N
Molecular Weight 252.398 g/mol
SMILES [C@@]12(OC(=O)C)[C@@](C[C@@](CC2)(C(C)(C)C)[H])(CCCC1)[H]
SPLASH splash10-000i-1900000000-453320b7204ea13c5f18
Source of Spectrum B-31-819-0
Synonyms (2R,4aS,8aR)-2-tert-butyloctahydro-4a(2H)-naphthalenyl acetate 2.alpha.-t-butyl-1,3,4,5,6,7,8,8a.beta.-octahydronaphthalen-4a.alpha.(2H)-ylacetate
Wiley ID 1256134