SpectraBase Spectrum ID |
3RwRRCHiu7Z |
Name |
14,15,16,17-Tetradehydro-13,18-dimethyl-1,6-methano[24]annulene-9,22-dione |
Alternate Name(s) |
8,13-dimethylbicyclo[18.4.1]pentacosa-1(24),2,5,7,13,15,18,20,22-nonaene-9,11-diyne-4,17-dione |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H22O2 |
InChI |
InChI=1S/C27H22O2/c1-22-9-3-4-10-23(2)12-8-16-27(29)20-18-25-14-6-5-13-24(21-25)17-19-26(28)15-7-11-22/h5-8,11-20H,21H2,1-2H3/b15-7-,16-8+,19-17+,20-18+,22-11+,23-12- |
InChIKey |
KJVSCUZRWUUKLF-ZPFMUBDASA-N |
Molecular Weight |
378.471 g/mol |
SMILES |
C#1C#C\C(=C/C=C/C(\C=C\C2=CC=CC=C(\C=C\C(\C=C/C=C/(C1)C)=O)C2)=O)C |
SPLASH |
splash10-0udi-0902000000-567ce2ede0405c1c5baf |
Source of Spectrum |
KC-1993-97-5 |
Wiley ID |
778739 |