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2-Endo-octyl-7-norbornanone
SpectraBase Compound ID 6t4dg8y2Xyi
InChI InChI=1S/C15H26O/c1-2-3-4-5-6-7-8-12-11-13-9-10-14(12)15(13)16/h12-14H,2-11H2,1H3/t12-,13+,14-/m0/s1
InChIKey NKNARCWHCYWXCH-MJBXVCDLSA-N
Mol Weight 222.37 g/mol
Molecular Formula C15H26O
Exact Mass 222.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cz0ERRPLW5A
Name 2-Endo-octyl-7-norbornanone
Alternate Name(s) (1S,4R)-2-octylbicyclo[2.2.1]heptan-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O
InChI InChI=1S/C15H26O/c1-2-3-4-5-6-7-8-12-11-13-9-10-14(12)15(13)16/h12-14H,2-11H2,1H3/t12-,13+,14-/m0/s1
InChIKey NKNARCWHCYWXCH-MJBXVCDLSA-N
Literature Reference DOI 10.1021/ol071161b
Molecular Weight 222.372 g/mol
SMILES C1C[C@]2(C([C@@]1([C@@](CCCCCCCC)(C2)[H])[H])=O)[H]
SPLASH splash10-00l7-9000000000-eca35e079e30238b5a8c
Source of Spectrum A1-9-2943/SMS4-6
Wiley ID 1758342