| SpectraBase Spectrum ID |
JhbSWYWQsYz |
| Name |
1,3,5,7-Cyclooctatetraene-1-butanoic acid |
| Alternate Name(s) |
4-(1,3,5,7-cyclooctatetraenyl)butanoic acid
4-Cyclooctatetraenylbutanoic acid |
| CAS Registry Number |
57670-88-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H14O2 |
| InChI |
InChI=1S/C12H14O2/c13-12(14)10-6-9-11-7-4-2-1-3-5-8-11/h1-5,7-8H,6,9-10H2,(H,13,14)/b2-1-,3-1-,4-2-,5-3-,7-4-,8-5-,11-7+,11-8+ |
| InChIKey |
LDADICXDBBDUEC-KCPCKZTJSA-N |
| Molecular Weight |
190.242 g/mol |
| SMILES |
OC(CCC\C=1\C=C/C=C\C=C/C/1)=O |
| SPLASH |
splash10-014i-0900000000-eb9a1368576e999879db |
| Source of Spectrum |
B-28-2246-0 |
| Wiley ID |
1186661 |
