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3-( 2'-Methyl-3'-oxabicyclo[2.2.2]oct-2'-yl]-propanal
SpectraBase Compound ID 48YalqBQbJ9
InChI InChI=1S/C12H18O2/c1-12(7-2-8-13)10-5-3-9(4-6-10)11(12)14/h8-10H,2-7H2,1H3/t9-,10+,12-/m1/s1
InChIKey VMRMYVZOZIAMRO-JFGNBEQYSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4obGpEujYuD
Name 3-( 2'-Methyl-3'-oxabicyclo[2.2.2]oct-2'-yl]-propanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-12(7-2-8-13)10-5-3-9(4-6-10)11(12)14/h8-10H,2-7H2,1H3/t9-,10+,12-/m1/s1
InChIKey VMRMYVZOZIAMRO-JFGNBEQYSA-N
Molecular Weight 194.274 g/mol
SMILES [C@]1(C([C@]2(CC[C@@]1(CC2)[H])[H])=O)(CCC=O)C
SPLASH splash10-01p9-3900000000-469385c05d2973ce0ed2
Source of Spectrum AH-128-622-8
Synonyms 3-(2-Methyl-3-oxobicyclo[2.2.2]oct-2-yl)propanal
Wiley ID 1191261