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Tricyclo[3.3.1.13,7]decanone, 4-methyl-, [1S-(1.alpha.,3.beta.,4.beta.,5.alpha.,7.beta.)]-
SpectraBase Compound ID ErZj585fGgT
InChI InChI=1S/C11H16O/c1-6-8-2-7-3-9(5-8)11(12)10(6)4-7/h6-10H,2-5H2,1H3/t6-,7+,8-,9+,10-/m1/s1
InChIKey BKYMOTJGWMMVOU-MQIGXGKASA-N
Mol Weight 164.25 g/mol
Molecular Formula C11H16O
Exact Mass 164.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2OY7h8D2Xnd
Name Tricyclo[3.3.1.13,7]decanone, 4-methyl-, [1S-(1.alpha.,3.beta.,4.beta.,5.alpha.,7.beta.)]-
CAS Registry Number 79854-63-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O
InChI InChI=1S/C11H16O/c1-6-8-2-7-3-9(5-8)11(12)10(6)4-7/h6-10H,2-5H2,1H3/t6-,7+,8-,9+,10-/m1/s1
InChIKey BKYMOTJGWMMVOU-MQIGXGKASA-N
Molecular Weight 164.248 g/mol
SMILES [C@@]12(C([C@@]3([H])C[C@@](C2)(C[C@@]([C@]1(C)[H])(C3)[H])[H])=O)[H]
SPLASH splash10-03di-0900000000-bab926645a7e70d504c9
Source of Spectrum C-108-4495-2
Synonyms (+)-(1S,3R)-4(R)(E)-Methyladamantan (+)-(1S,3R,4R)-4(E)-Methyladamantan-2-one (+)-(1S,3R,4S)-4(a)-Methyladamantane (1R,3R,4R)-4-methyltricyclo[3.3.1.1(3,7)]decan-2-one
Wiley ID 1160840