SpectraBase Spectrum ID |
9xxtc5X57Le |
Name |
bis[4-(Hydroxycarbonyl)-[2.2]paracyclophanyl-12]-ketone |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C35H30O5 |
InChI |
InChI=1S/C35H30O5/c36-33(29-17-21-1-9-25(29)11-3-23-7-15-27(13-5-21)31(19-23)34(37)38)30-18-22-2-10-26(30)12-4-24-8-16-28(14-6-22)32(20-24)35(39)40/h1-2,7-10,15-20H,3-6,11-14H2,(H,37,38)(H,39,40) |
InChIKey |
STANXVNHBSLGOD-UHFFFAOYSA-N |
Molecular Weight |
530.620 g/mol |
SMILES |
OC(c1c2CCc3ccc(c(C(c4cc5CCc6c(C(=O)O)cc(CCc4cc5)cc6)=O)c3)CCc(c1)cc2)=O |
SPLASH |
splash10-0f89-0940010000-ea1e25d78e0e1ce3311e |
Source of Spectrum |
QF-46-1899-6 |
Wiley ID |
833664 |