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[4-Hydroxymethyl-2-propyl-3-methyl-1-oxooctahydropentalen-6-yl]methyl acetate
SpectraBase Compound ID 3fTgFA9Xghj
InChI InChI=1S/C16H26O4/c1-4-5-13-9(2)14-11(7-17)6-12(8-20-10(3)18)15(14)16(13)19/h9,11-15,17H,4-8H2,1-3H3
InChIKey NUBNADDICMKYRZ-UHFFFAOYSA-N
Mol Weight 282.38 g/mol
Molecular Formula C16H26O4
Exact Mass 282.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FHLmix8niRm
Name [4-Hydroxymethyl-2-propyl-3-methyl-1-oxooctahydropentalen-6-yl]methyl acetate
Alternate Name(s) [3-(hydroxymethyl)-4-methyl-6-oxo-5-propyloctahydro-1-pentalenyl]methyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O4
InChI InChI=1S/C16H26O4/c1-4-5-13-9(2)14-11(7-17)6-12(8-20-10(3)18)15(14)16(13)19/h9,11-15,17H,4-8H2,1-3H3
InChIKey NUBNADDICMKYRZ-UHFFFAOYSA-N
Molecular Weight 282.380 g/mol
SMILES OCC1C2C(C(C(C2C(COC(C)=O)C1)=O)CCC)C
SPLASH splash10-00pi-7950000000-3d9341930257cde705b1
Source of Spectrum K1-0-2221-4
Wiley ID 1588873