| SpectraBase Spectrum ID |
LGXQxSRc7Bo |
| Name |
(1'-Pyrenyl)-acetic Acid |
| CAS Registry Number |
64709-55-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H12O2 |
| InChI |
InChI=1S/C18H12O2/c19-16(20)10-14-7-6-13-5-4-11-2-1-3-12-8-9-15(14)18(13)17(11)12/h1-9H,10H2,(H,19,20) |
| InChIKey |
SDJCLYBBPUHKCD-UHFFFAOYSA-N |
| Molecular Weight |
260.292 g/mol |
| SMILES |
OC(Cc1c2c3c4c(cc2)cccc4ccc3cc1)=O |
| SPLASH |
splash10-014i-0090000000-a090a21f87b9623ad5ea |
| Source of Spectrum |
CRT-6-40-D |
| Synonyms |
2-(1-pyrenyl)acetic acid
2-pyren-1-ylethanoic acid |
| Wiley ID |
1709386 |
