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2-[(2R,6R)-2-[[(4S,8R,11S)-11-isopropyl-8-methyl-1,5-dioxaspiro[5.5]undecan-4-yl]methyl]-3,6-dihydro-2H-pyran-6-yl]acetaldehyde

View entire compound with spectra: 1 MS (GC)

2-[(2R,6R)-2-[[(4S,8R,11S)-11-isopropyl-8-methyl-1,5-dioxaspiro[5.5]undecan-4-yl]methyl]-3,6-dihydro-2H-pyran-6-yl]acetaldehyde
SpectraBase Compound ID I6nnSSSsJNV
InChI InChI=1S/C21H34O4/c1-15(2)20-8-7-16(3)14-21(20)23-12-10-19(25-21)13-18-6-4-5-17(24-18)9-11-22/h4-5,11,15-20H,6-10,12-14H2,1-3H3/t16-,17+,18-,19+,20+,21?/m1/s1
InChIKey SCNKNPBBDOUARO-VVWVRIMMSA-N
Mol Weight 350.5 g/mol
Molecular Formula C21H34O4
Exact Mass 350.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ENlMV2od5bp
Name 2-[(2R,6R)-2-[[(4S,8R,11S)-11-isopropyl-8-methyl-1,5-dioxaspiro[5.5]undecan-4-yl]methyl]-3,6-dihydro-2H-pyran-6-yl]acetaldehyde
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O4
InChI InChI=1S/C21H34O4/c1-15(2)20-8-7-16(3)14-21(20)23-12-10-19(25-21)13-18-6-4-5-17(24-18)9-11-22/h4-5,11,15-20H,6-10,12-14H2,1-3H3/t16-,17+,18-,19+,20+,21?/m1/s1
InChIKey SCNKNPBBDOUARO-VVWVRIMMSA-N
Ionization Type EI
Molecular Weight 350.499 g/mol
Optical Rotation [a]D27 = 0 (CH2Cl2)
Reported Formula C21H34O4
SMILES C1C[C@](OC2(O1)C[C@@](CC[C@]2(C(C)C)[H])(C)[H])(C[C@]1(CC=C[C@](O1)(CC=O)[H])[H])[H]
SPLASH splash10-00m0-9154000000-6bd0f608166bc15a35df
Source of Spectrum US20100280262A1
Thin-Layer Chromatography Rf = 0.75 (30% EtOAc/hexanes)
Wiley ID 1844165