| SpectraBase Spectrum ID |
FSDSJtvmeXM |
| Name |
2,4,6-Cycloheptatrien-1-one, 2-[[4-(1,1-dimethylethyl)phenyl]methyl]- |
| Alternate Name(s) |
2-(4-t-butyl-benzyl)tropone
2-(4-tert-butylbenzyl)-2,4,6-cycloheptatrien-1-one |
| CAS Registry Number |
128456-84-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H20O |
| InChI |
InChI=1S/C18H20O/c1-18(2,3)16-11-9-14(10-12-16)13-15-7-5-4-6-8-17(15)19/h4-12H,13H2,1-3H3 |
| InChIKey |
VEALCBPPHFERAQ-UHFFFAOYSA-N |
| Molecular Weight |
252.357 g/mol |
| SMILES |
C=1(C(C=CC=CC1)=O)Cc1ccc(C(C)(C)C)cc1 |
| SPLASH |
splash10-0ue0-0090000000-8a6234e7b9db2a4b64e1 |
| Source of Spectrum |
KC-1990-1003-10 |
| Wiley ID |
1256386 |
