| SpectraBase Spectrum ID |
HnCruwyeuVb |
| Name |
4,5,6,8,16-Pentamethyl[2.2]metacyclophane |
| Alternate Name(s) |
5,6,7,15,16-Pentamethyl-tricyclo[9.3.1.1*4,8*]hexadeca-1(14),4,6,8(16),11(15),12-hexaene
5,6,7,15,16-pentamethyltricyclo[9.3.1.1(4,8)]hexadeca-1(15),4(16),5,7,11,13-hexaene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26 |
| InChI |
InChI=1S/C21H26/c1-13-14(2)20-11-9-18-7-6-8-19(16(18)4)10-12-21(15(13)3)17(20)5/h6-8H,9-12H2,1-5H3 |
| InChIKey |
ALPIKOIPIQSYAX-UHFFFAOYSA-N |
| Molecular Weight |
278.439 g/mol |
| SMILES |
c12c(c(CCc3c(c(CC2)ccc3)C)c(c(c1C)C)C)C |
| SPLASH |
splash10-002b-0090000000-c616b410c581bf65906d |
| Source of Spectrum |
KC-0-1369-6 |
| Wiley ID |
824986 |
![4,5,6,8,16-Pentamethyl[2.2]metacyclophane](/api/spectrum/HnCruwyeuVb/structure.png?h=300&w=458 "4,5,6,8,16-Pentamethyl[2.2]metacyclophane")
