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4-Methyl-1-acetoxy-myodesertane

View entire compound with spectra: 2 MS (GC)

4-Methyl-1-acetoxy-myodesertane
SpectraBase Compound ID HTQUTgzIWe4
InChI InChI=1S/C12H20O3/c1-7-4-5-10-8(2)6-14-12(11(7)10)15-9(3)13/h7-8,10-12H,4-6H2,1-3H3/t7-,8+,10-,11+,12+/m1/s1
InChIKey NIRNTUOLYBGEIF-HINXJTCJSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6dRYafz8dae
Name 4-Methyl-1-acetoxy-myodesertane
Alternate Name(s) (1S,7aS)-1-acetoxymyodesertan (1S,4R,4aR,7R,7aS)-4,7-dimethyloctahydrocyclopenta[c]pyran-1-yl acetate
CAS Registry Number 96037-84-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-7-4-5-10-8(2)6-14-12(11(7)10)15-9(3)13/h7-8,10-12H,4-6H2,1-3H3/t7-,8+,10-,11+,12+/m1/s1
InChIKey NIRNTUOLYBGEIF-HINXJTCJSA-N
Molecular Weight 212.289 g/mol
SMILES [C@]1([C@@]2([C@@](CC[C@]2(C)[H])([H])[C@](CO1)(C)[H])[H])(OC(=O)C)[H]
SPLASH splash10-001c-9500000000-a36d1b6b2c51525bdf79
Source of Spectrum B-38-334-10
Wiley ID 1211491