SpectraBase Spectrum ID |
1iYyAqCXtwj |
Name |
(3'aR*,6'S*,7'aR*)-spiro[cyclohexane-1,3'-6'-(4-chlorobenzoyloxymethyl)-perhydrofuro[2,3-b]pyran] |
Appearance |
Colourless viscous oil |
Carrier Gas |
Helium (1.4 ml/min) |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H25ClO4 |
GC Column |
Macherey-Nagel Optima delta-3 (20 m x 0.25 mm, film thickness 0.25 micrometer) |
GC Oven Program |
Oven temp 280oC |
InChI |
InChI=1S/C20H25ClO4/c21-15-6-4-14(5-7-15)18(22)23-12-16-8-9-17-19(25-16)24-13-20(17)10-2-1-3-11-20/h4-7,16-17,19H,1-3,8-13H2/t16-,17-,19+/m0/s1 |
InChIKey |
XAMDKSTZUSIXDW-JENIJYKNSA-N |
Inlet Type |
Split |
Instrument Name |
Finnigan Trace GC/MS |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.201604950 |
Molecular Weight |
364.869 g/mol |
Quality |
164 |
Reported Formula |
C20H25O4(35)Cl |
SMILES |
C1(Cl)=CC=C(C(=O)OC[C@]2(O[C@@]3([C@](CC2)(C2(CO3)CCCCC2)[H])[H])[H])C=C1 |
SPLASH |
splash10-0uds-3900000000-fa41702d528880b8978f |
Source of Spectrum |
ACI-55-SM22-9f (DOI: 10.1002/anie.201604950) |
Wiley ID |
1899234 |