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Pentalene, octahydro-1,3a,4,6a-tetramethyl-, [1R-(1.alpha.,3a.alpha.,4.alpha.,6a.alpha.)]-
SpectraBase Compound ID Fqz2Y86VHFn
InChI InChI=1S/C12H22/c1-9-5-7-12(4)10(2)6-8-11(9,12)3/h9-10H,5-8H2,1-4H3/t9-,10-,11+,12+/m1/s1
InChIKey KROCWGYPGMHGRM-WYUUTHIRSA-N
Mol Weight 166.31 g/mol
Molecular Formula C12H22
Exact Mass 166.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6cdd3n9TmBO
Name Pentalene, octahydro-1,3a,4,6a-tetramethyl-, [1R-(1.alpha.,3a.alpha.,4.alpha.,6a.alpha.)]-
Alternate Name(s) (1R,3aS,4R,6aS)-1,3a,4,6a-tetramethyloctahydropentalene 1,2,5,6-Tetramethylbicyclo[3.3.0]octane
CAS Registry Number 81674-90-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22
InChI InChI=1S/C12H22/c1-9-5-7-12(4)10(2)6-8-11(9,12)3/h9-10H,5-8H2,1-4H3/t9-,10-,11+,12+/m1/s1
InChIKey KROCWGYPGMHGRM-WYUUTHIRSA-N
Molecular Weight 166.308 g/mol
SMILES [C@@]12([C@@](CC[C@]2(C)[H])([C@](C)(CC1)[H])C)C
SPLASH splash10-05o0-7900000000-f90d4abaef79aecec2c9
Source of Spectrum AJ-56-1132-25
Wiley ID 1163320