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3-Acetyl-3'-n-butyl[2]staffane
SpectraBase Compound ID 47wOpUwoi5U
InChI InChI=1S/C16H24O/c1-3-4-5-13-6-15(7-13,8-13)16-9-14(10-16,11-16)12(2)17/h3-11H2,1-2H3
InChIKey HPWBLQNINVFIQV-UHFFFAOYSA-N
Mol Weight 232.37 g/mol
Molecular Formula C16H24O
Exact Mass 232.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FP3xuDzUVrp
Name 3-Acetyl-3'-n-butyl[2]staffane
Alternate Name(s) 1-(3-{3-butylbicyclo[1.1.1]pentan-1-yl}bicyclo[1.1.1]pentan-1-yl)ethan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O
InChI InChI=1S/C16H24O/c1-3-4-5-13-6-15(7-13,8-13)16-9-14(10-16,11-16)12(2)17/h3-11H2,1-2H3
InChIKey HPWBLQNINVFIQV-UHFFFAOYSA-N
Molecular Weight 232.367 g/mol
SMILES C12(C34CC(C4)(CCCC)C3)CC(C1)(C(=O)C)C2
SPLASH splash10-052f-7900000000-48b03d5f16fa7741e885
Source of Spectrum C-114-616-2
Wiley ID 1234439