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(Tetrahydro-spiro[1,3-dioxolane-2,2'-(1'H)-pentalen]-5'(3'H)-ylidene)-5-methyl-2-(1'-methyl-1'-phenylethyl)cyclohexyl acetate

View entire compound with spectra: 1 MS (GC)

(Tetrahydro-spiro[1,3-dioxolane-2,2'-(1'H)-pentalen]-5'(3'H)-ylidene)-5-methyl-2-(1'-methyl-1'-phenylethyl)cyclohexyl acetate
SpectraBase Compound ID 5v4IzSugF4R
InChI InChI=1S/C28H38O4/c1-19-9-10-24(27(2,3)23-7-5-4-6-8-23)25(13-19)32-26(29)16-20-14-21-17-28(18-22(21)15-20)30-11-12-31-28/h4-8,16,19,21-22,24-25H,9-15,17-18H2,1-3H3
InChIKey ATJKNOHSWWIDIX-UHFFFAOYSA-N
Mol Weight 438.6 g/mol
Molecular Formula C28H38O4
Exact Mass 438.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HITMCMD7pUA
Name (Tetrahydro-spiro[1,3-dioxolane-2,2'-(1'H)-pentalen]-5'(3'H)-ylidene)-5-methyl-2-(1'-methyl-1'-phenylethyl)cyclohexyl acetate
Alternate Name(s) 5-Methyl-2-(2-phenylpropan-2-yl)cyclohexyl 2-{hexahydro-1'H-spiro[1,3-dioxolane-2,2'-pentalene]-5'-ylidene}acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H38O4
InChI InChI=1S/C28H38O4/c1-19-9-10-24(27(2,3)23-7-5-4-6-8-23)25(13-19)32-26(29)16-20-14-21-17-28(18-22(21)15-20)30-11-12-31-28/h4-8,16,19,21-22,24-25H,9-15,17-18H2,1-3H3
InChIKey ATJKNOHSWWIDIX-UHFFFAOYSA-N
Molecular Weight 438.608 g/mol
SMILES C12(CC3CC(CC3C2)=CC(OC2C(C(c3ccccc3)(C)C)CCC(C2)C)=O)OCCO1
SPLASH splash10-066r-5930000000-170bd2cf68a254586ea1
Source of Spectrum U-1997-2428-7
Wiley ID 820317