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Tricyclo[3.3.1.13,7]decanone, 4-(1-methylethyl)-, [1S-(1.alpha.,3.beta.,4.beta.,5.alpha.,7.beta.)]-
SpectraBase Compound ID 8xjSaQbqCLF
InChI InChI=1S/C13H20O/c1-7(2)12-9-3-8-4-10(6-9)13(14)11(12)5-8/h7-12H,3-6H2,1-2H3/t8?,9-,10+,11-,12+/m1/s1
InChIKey GYRRHIUBRMIZDR-FGLXMSFASA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 50WsACieTSP
Name Tricyclo[3.3.1.13,7]decanone, 4-(1-methylethyl)-, [1S-(1.alpha.,3.beta.,4.beta.,5.alpha.,7.beta.)]-
CAS Registry Number 103364-80-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C13H20O/c1-7(2)12-9-3-8-4-10(6-9)13(14)11(12)5-8/h7-12H,3-6H2,1-2H3/t8?,9-,10+,11-,12+/m1/s1
InChIKey GYRRHIUBRMIZDR-FGLXMSFASA-N
Molecular Weight 192.302 g/mol
SMILES [C@@]12(C([C@@]3([H])CC(C2)C[C@@]([C@@]1(C(C)C)[H])(C3)[H])=O)[H]
SPLASH splash10-00dj-0900000000-13c91129e2e6d39fba57
Source of Spectrum C-108-4496-6
Synonyms (+)-(1S,3R)-4(E)-Isopropyladamantan-2-one (1R,3R)-4-isopropyltricyclo[3.3.1.1(3,7)]decan-2-one
Wiley ID 1188960