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6,6-DIMETHYL-TRANS-2-METHYL-3-OXOBICYCLO-[3.1.1]-HEPTAN,PINOCAMPHON
SpectraBase Compound ID DHrZIANKBsn
InChI InChI=1S/C10H16O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-8H,4-5H2,1-3H3/t6-,7-,8+/m0/s1
InChIKey MQPHVIPKLRXGDJ-BIIVOSGPSA-N
Mol Weight 152.24 g/mol
Molecular Formula C10H16O
Exact Mass 152.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JvosYFpiCZv
Name (+)-(1R,2S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O
InChI InChI=1S/C10H16O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-8H,4-5H2,1-3H3/t6-,7-,8+/m0/s1
InChIKey MQPHVIPKLRXGDJ-BIIVOSGPSA-N
Instrument Name VG Analytical 70-250SE
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290080406
Molecular Weight 152.237 g/mol
SMILES [C@]12([C@@](C(C[C@](C2)(C1(C)C)[H])=O)(C)[H])[H]
SPLASH splash10-05o0-9000000000-0793e9ad24c22a23ff43
Source of Spectrum RCM-8-314-2
Synonyms trans-3-pinanone
Wiley ID 1837357