SpectraBase Spectrum ID |
DMDOIzDHG1d |
Name |
Furocalixarene |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C48H52O6 |
InChI |
InChI=1S/C48H52O6/c1-41(2)31-17-18-32(49-31)42(3,4)34-20-22-36(51-34)44(7,8)38-24-26-40(53-38)46(11,12)48-28-27-47(54-48,29-15-13-14-16-30(29)48)45(9,10)39-25-23-37(52-39)43(5,6)35-21-19-33(41)50-35/h13-28H,1-12H3 |
InChIKey |
DZOKRGGZJHOKNQ-UHFFFAOYSA-N |
Molecular Weight |
724.938 g/mol |
SMILES |
C123OC(C(c4oc(C(c5oc(C(C)(C)c6oc(C(c7oc(C(c8oc(C3(C)C)cc8)(C)C)cc7)(C)C)cc6)cc5)(C)C)cc4)(C)C)(C=C2)c2c1cccc2 |
SPLASH |
splash10-0bt9-0010000900-6029be8d00d30154b256 |
Source of Spectrum |
QE-5-365-1 |
Wiley ID |
843919 |