Pentacyclo[4.3.0.02,5.03,8.04,7]nonan-4-ol, acetate

SpectraBase Compound ID	IJwhWWgXJoe
InChI	InChI=1S/C11H12O2/c1-3(12)13-11-8-5-2-4-6(8)10(11)7(4)9(5)11/h4-10H,2H2,1H3/t4-,5+,6-,7+,8+,9?,10+,11?/m1/s1
InChIKey	CUQDFNREWZPCKL-SHIBIXHISA-N Google Search
Mol Weight	176.21 g/mol
Molecular Formula	C11H12O2
Exact Mass	176.08373 g/mol

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SpectraBase Spectrum ID	6frF93aU255
Name	Pentacyclo[4.3.0.02,5.03,8.04,7]nonan-4-ol, acetate
Alternate Name(s)	4-Homocubyl acetate Pentacyclo[4.3.0.0(2,5).0(3,8).0(4,7)]non-4-yl acetate
CAS Registry Number	84790-10-3
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C11H12O2
InChI	InChI=1S/C11H12O2/c1-3(12)13-11-8-5-2-4-6(8)10(11)7(4)9(5)11/h4-10H,2H2,1H3/t4-,5+,6-,7+,8+,9?,10+,11?/m1/s1
InChIKey	CUQDFNREWZPCKL-SHIBIXHISA-N
Molecular Weight	176.215 g/mol
SMILES	C12([C@@]3([C@@]4([C@]2([C@@]2(C1[C@]3(C[C@]42[H])[H])[H])[H])[H])[H])OC(=O)C
SPLASH	splash10-0006-9500000000-cae79287ca5ba840e3d1
Source of Spectrum	W5-1989-35434-30102
Wiley ID	1172435