| SpectraBase Spectrum ID |
787eq2Ladz7 |
| Name |
1-Benzyltriptycene |
| Alternate Name(s) |
1-benzylpentacyclo[6.6.6.0(2,7).0(9,14).0(15,20)]icosa-2,4,6,9,11,13,15,17,19-nonaene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H20 |
| InChI |
InChI=1S/C27H20/c1-2-10-19(11-3-1)18-27-23-15-7-4-12-20(23)26(21-13-5-8-16-24(21)27)22-14-6-9-17-25(22)27/h1-17,26H,18H2 |
| InChIKey |
OKMQDQIABUHQKR-UHFFFAOYSA-N |
| Molecular Weight |
344.457 g/mol |
| SMILES |
C12(c3c(cccc3)C(c3c1cccc3)c1c2cccc1)Cc1ccccc1 |
| SPLASH |
splash10-0udi-0092000000-c79c1fda1ac019cae2be |
| Source of Spectrum |
KC-0-567-1 |
| Wiley ID |
785140 |
