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(1S,2S,5R,9R)-1,4,4-Trimethyltricyclo[7.2.1.0(2,5)]dodecane-8-one
SpectraBase Compound ID 4gHMZpxD7ED
InChI InChI=1S/C15H24O/c1-14(2)9-12-11(14)4-5-13(16)10-6-7-15(12,3)8-10/h10-12H,4-9H2,1-3H3/t10-,11-,12+,15+/m1/s1
InChIKey UALJSKIUEUMUMH-FJJYHAOUSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Z20FmMSqFF
Name (1S,2S,5R,9R)-1,4,4-Trimethyltricyclo[7.2.1.0(2,5)]dodecane-8-one
Alternate Name(s) (1S,2S,5R,9R)-1,4,4-trimethyltricyclo[7.2.1.0(2,5)]dodecan-8-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O
InChI InChI=1S/C15H24O/c1-14(2)9-12-11(14)4-5-13(16)10-6-7-15(12,3)8-10/h10-12H,4-9H2,1-3H3/t10-,11-,12+,15+/m1/s1
InChIKey UALJSKIUEUMUMH-FJJYHAOUSA-N
Molecular Weight 220.356 g/mol
SMILES [C@@]12([C@@]3([C@](CCC([C@](C2)([H])CC1)=O)([H])C(C3)(C)C)[H])C
SPLASH splash10-0a4i-9010000000-5ea51421eaa93022e2b2
Source of Spectrum J-65-7790-8
Wiley ID 1533800