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Pentacyclo[4.2.0.02,5.03,8.04,7]octanol
SpectraBase Compound ID 5wCfJbORGz0
InChI InChI=1S/C8H8O/c9-8-5-2-1-3(5)7(8)4(1)6(2)8/h1-7,9H/t1-,2+,3-,4+,5+,6-,7+,8+
InChIKey IRVFOVXWROKKRY-FRWDXULISA-N
Mol Weight 120.15 g/mol
Molecular Formula C8H8O
Exact Mass 120.057515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5e4o4waJpWJ
Name Pentacyclo[4.2.0.02,5.03,8.04,7]octanol
Alternate Name(s) (2r,3r,5r,6r,7r,8r)-cuban-1-ol 1-Cubanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8O
InChI InChI=1S/C8H8O/c9-8-5-2-1-3(5)7(8)4(1)6(2)8/h1-7,9H/t1-,2+,3-,4+,5+,6-,7+,8+
InChIKey IRVFOVXWROKKRY-FRWDXULISA-N
Literature Reference DOI 10.1021/ol901302d
Molecular Weight 120.151 g/mol
SMILES OC12[C@]3([C@]4([C@@]2([C@@]2(C4[C@]3([C@]12[H])[H])[H])[H])[H])[H]
SPLASH splash10-0006-9100000000-380f8b4d5d65f1d4a3c6
Source of Spectrum A1-11-3574/SMS3-6
Wiley ID 1757093