| SpectraBase Spectrum ID |
21YMwDRat8K |
| Name |
3-phenylenanthic acid methyl ester |
| Alternate Name(s) |
3-phenylheptanoic acid methyl ester
methyl 3-phenylheptanoate |
| CAS Registry Number |
64199-01-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H20O2 |
| InChI |
InChI=1S/C14H20O2/c1-3-4-8-13(11-14(15)16-2)12-9-6-5-7-10-12/h5-7,9-10,13H,3-4,8,11H2,1-2H3 |
| InChIKey |
XPDDRXJDEIRDJY-UHFFFAOYSA-N |
| Molecular Weight |
220.312 g/mol |
| SMILES |
C(CC(c1ccccc1)CCCC)(=O)OC |
| SPLASH |
splash10-0006-9010000000-10ddcc74008167665be0 |
| Source of Spectrum |
F-44-2061-0 |
| Wiley ID |
1220189 |
