3-Acetyl-3""-n-butyl[5]staffane

SpectraBase Compound ID	6dQflJmGEFj
InChI	InChI=1S/C31H42O/c1-3-4-5-12-13-6-14(12)24(13)26-17-8-18(26)28(17)30-21-10-22(30)31(21)29-19-9-20(29)27(19)25-15-7-16(25)23(15)11(2)32/h12-31H,3-10H2,1-2H3
InChIKey	QPYFWOATVJAEDT-UHFFFAOYSA-N Google Search
Mol Weight	430.7 g/mol
Molecular Formula	C31H42O
Exact Mass	430.323566 g/mol

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SpectraBase Spectrum ID	6XEGVGOe2kd
Name	3-Acetyl-3""-n-butyl[5]staffane
Alternate Name(s)	1-(4-{4-[4-(4-{4-butylbicyclo[1.1.1]pentan-2-yl}bicyclo[1.1.1]pentan-2-yl)bicyclo[1.1.1]pentan-2-yl]bicyclo[1.1.1]pentan-2-yl}bicyclo[1.1.1]pentan-2-yl)ethan-1-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C31H42O
InChI	InChI=1S/C31H42O/c1-3-4-5-12-13-6-14(12)24(13)26-17-8-18(26)28(17)30-21-10-22(30)31(21)29-19-9-20(29)27(19)25-15-7-16(25)23(15)11(2)32/h12-31H,3-10H2,1-2H3
InChIKey	QPYFWOATVJAEDT-UHFFFAOYSA-N
Molecular Weight	430.676 g/mol
SMILES	C1(C2C3CC2C3C(=O)C)C2C(C1C2)C1C2C(C1C2)C1C2C(C1C2)C1C2CC1C2CCCC
SPLASH	splash10-052f-9200000000-64935b14636db50a8044
Source of Spectrum	C-114-616-5
Wiley ID	1381876