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[1S,4aR,8aR] - 1,2,3,4,4a,5,8,8a - octahydro - 1 - methoxymethyl - 1,4a,6 - trimethyl - naphthalene (so Anderson)
SpectraBase Compound ID 2PNCDBJALTs
InChI InChI=1S/C15H26O/c1-12-6-7-13-14(2,10-12)8-5-9-15(13,3)11-16-4/h6,13H,5,7-11H2,1-4H3/t13-,14-,15-/m1/s1
InChIKey OETJNBASBVBQCK-RBSFLKMASA-N
Mol Weight 222.37 g/mol
Molecular Formula C15H26O
Exact Mass 222.198365 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FzsPP4aNyr5
Name [1S,4ar,8ar] - 1,2,3,4,4A,5,8,8A - Octahydro - 1 - methoxymethyl - 1,4A,6 - trimethyl - naphthalene (so anderson)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.198365456 u
Formula C15H26O
InChI InChI=1S/C15H26O/c1-12-6-7-13-14(2,10-12)8-5-9-15(13,3)11-16-4/h6,13H,5,7-11H2,1-4H3/t13-,14-,15-/m1/s1
InChIKey OETJNBASBVBQCK-RBSFLKMASA-N
Molecular Weight 222.372 g/mol
SMILES [C@]12([C@@](CC=C(C2)C)([C@](COC)(C)CCC1)[H])C