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[6-Hydroxymethyl-2-pentyl-3-butyl-1-oxooctahydropentalen-4-yl]methyl acetate
SpectraBase Compound ID 6WuXWLHB0xE
InChI InChI=1S/C21H36O4/c1-4-6-8-10-18-17(9-7-5-2)19-16(13-25-14(3)23)11-15(12-22)20(19)21(18)24/h15-20,22H,4-13H2,1-3H3
InChIKey HFJNKVSTEBZIHR-UHFFFAOYSA-N
Mol Weight 352.5 g/mol
Molecular Formula C21H36O4
Exact Mass 352.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 52xcUrl8Vy9
Name [6-Hydroxymethyl-2-pentyl-3-butyl-1-oxooctahydropentalen-4-yl]methyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O4
InChI InChI=1S/C21H36O4/c1-4-6-8-10-18-17(9-7-5-2)19-16(13-25-14(3)23)11-15(12-22)20(19)21(18)24/h15-20,22H,4-13H2,1-3H3
InChIKey HFJNKVSTEBZIHR-UHFFFAOYSA-N
Molecular Weight 352.515 g/mol
SMILES OCC1CC(COC(C)=O)C2C(C(C(C12)=O)CCCCC)CCCC
SPLASH splash10-004i-3390000000-6bf368a5bda0163614ed
Source of Spectrum K1-0-2223-5
Synonyms [6-butyl-3-(hydroxymethyl)-4-oxo-5-pentyloctahydro-1-pentalenyl]methyl acetate
Wiley ID 1588859