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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
Mol Weight 176.21 g/mol
Molecular Formula C11H12O2
Exact Mass 176.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6frF93aU255
Name Pentacyclo[4.3.0.02,5.03,8.04,7]nonan-4-ol, 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
Synonyms 4-Homocubyl acetate Pentacyclo[4.3.0.0(2,5).0(3,8).0(4,7)]non-4-yl acetate
Wiley ID 1172435