| SpectraBase Spectrum ID |
6KgOYsgpe9Q |
| Name |
17-Methyl[2.2.2](1,3,5)benzeno(3,3',3'')triphenylmethanophane |
| Alternate Name(s) |
1-methylhexacyclo[9.9.7.1(2,6).1(9,13).1(16,20).1(21,25)]hentriaconta-2(31),3,5,9,11,13(30),16(29),17,19,21(28),22,24-dodecaene
17-Methyl[2.2.2](1,3,5)benzeno(3,3',3'')triphenylmethanophane |
| CAS Registry Number |
73651-37-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H30 |
| InChI |
InChI=1S/C32H30/c1-32-29-8-2-5-23(20-29)11-14-26-17-27(15-12-24-6-3-9-30(32)21-24)19-28(18-26)16-13-25-7-4-10-31(32)22-25/h2-10,17-22H,11-16H2,1H3 |
| InChIKey |
QSEWWLBEAIFSSS-UHFFFAOYSA-N |
| Molecular Weight |
414.592 g/mol |
| SMILES |
C12(c3cc(CCc4cc(CCc5cc2ccc5)cc(CCc2cc1ccc2)c4)ccc3)C |
| SPLASH |
splash10-03dj-0004900000-d97bc6021936d57006ee |
| Source of Spectrum |
J-46-1614-0 |
| Wiley ID |
1375859 |
benzeno(3,3',3'')triphenylmethanophane](/api/spectrum/6KgOYsgpe9Q/structure.png?h=300&w=458 "17-Methyl[2.2.2](1,3,5)benzeno(3,3',3'')triphenylmethanophane")
