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1H-Indene-1,4(2H)-dione, hexahydro-2,3a,7a-trimethyl-, (3a.alpha.,7a.beta.)-
SpectraBase Compound ID LTfY1bnm7w1
InChI InChI=1S/C12H18O2/c1-8-7-12(3)9(13)5-4-6-11(12,2)10(8)14/h8H,4-7H2,1-3H3/t8?,11-,12+/m1/s1
InChIKey ROKPYUDEXOJTKW-HXBSPLPWSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A7pcc06oHD4
Name 1H-Indene-1,4(2H)-dione, hexahydro-2,3a,7a-trimethyl-, (3a.alpha.,7a.beta.)-
Alternate Name(s) (1.beta.,6.alpha.,8.XI.)-1,6,8-trimethylbicylo(4.3.0)nonane-1,7-dione (3aR,7aS)-2,3a,7a-trimethylhexahydro-1H-indene-1,4(2H)-dione
CAS Registry Number 62618-24-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-8-7-12(3)9(13)5-4-6-11(12,2)10(8)14/h8H,4-7H2,1-3H3/t8?,11-,12+/m1/s1
InChIKey ROKPYUDEXOJTKW-HXBSPLPWSA-N
Molecular Weight 194.274 g/mol
SMILES [C@]12([C@@](C(=O)C(C2)C)(CCCC1=O)C)C
SPLASH splash10-0204-2900000000-5485831c51b1b7a2696d
Source of Spectrum C-99-1967-0
Wiley ID 1191011