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[4-Hydroxymethyl-2-butyl-3-phenyl-1-oxooctahydropentalen-6-yl]methyl acetate
SpectraBase Compound ID JvjKnP6MPcg
InChI InChI=1S/C22H30O4/c1-3-4-10-18-19(15-8-6-5-7-9-15)20-16(12-23)11-17(13-26-14(2)24)21(20)22(18)25/h5-9,16-21,23H,3-4,10-13H2,1-2H3
InChIKey MMEFXLMWCUBEKU-UHFFFAOYSA-N
Mol Weight 358.48 g/mol
Molecular Formula C22H30O4
Exact Mass 358.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FpWGhuPp5qU
Name [4-Hydroxymethyl-2-butyl-3-phenyl-1-oxooctahydropentalen-6-yl]methyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O4
InChI InChI=1S/C22H30O4/c1-3-4-10-18-19(15-8-6-5-7-9-15)20-16(12-23)11-17(13-26-14(2)24)21(20)22(18)25/h5-9,16-21,23H,3-4,10-13H2,1-2H3
InChIKey MMEFXLMWCUBEKU-UHFFFAOYSA-N
Molecular Weight 358.478 g/mol
SMILES OCC1C2C(C(C(C2c2ccccc2)CCCC)=O)C(C1)COC(=O)C
SPLASH splash10-0006-7950000000-a6cf1e59b82390258c39
Source of Spectrum K1-0-2223-4
Synonyms [5-butyl-3-(hydroxymethyl)-6-oxo-4-phenyloctahydro-1-pentalenyl]methyl acetate
Wiley ID 1588864