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Tricyclo[3.3.0.02,4]octan-6-one, 1,3,3-trimethyl-, (1.alpha.,2.beta.,4.alpha.,5.beta.)-(.+-.)-
SpectraBase Compound ID F063zanb2wA
InChI InChI=1S/C11H16O/c1-10(2)8-7-6(12)4-5-11(7,3)9(8)10/h7-9H,4-5H2,1-3H3/t7-,8-,9-,11+/m0/s1
InChIKey RBCIBQVWPKBRNU-FTYOSLGDSA-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 FjSqtmZZbpn
Name Tricyclo[3.3.0.02,4]octan-6-one, 1,3,3-trimethyl-, (1.alpha.,2.beta.,4.alpha.,5.beta.)-(.+-.)-
CAS Registry Number 117873-24-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O
InChI InChI=1S/C11H16O/c1-10(2)8-7-6(12)4-5-11(7,3)9(8)10/h7-9H,4-5H2,1-3H3/t7-,8-,9-,11+/m0/s1
InChIKey RBCIBQVWPKBRNU-FTYOSLGDSA-N
Molecular Weight 164.248 g/mol
SMILES [C@@]12(C(C)(C)[C@@]2([H])[C@]2([C@]1(CCC2=O)C)[H])[H]
SPLASH splash10-0a4l-4900000000-3f759eabeafd71134205
Source of Spectrum K-122-540-7
Synonyms (1S,2S,4R,5S)-1,3,3-trimethyltricyclo[3.3.0.0(2,4)]octan-6-one 1,3,3-Trimethyl-cis,exo-tricyclo[3.3.0.0(2,4)]octan-6-one
Wiley ID 1160925