| SpectraBase Spectrum ID |
HtYibCrDZjZ |
| Name |
Cycloheptanecarboxylic acid, 1-(iodomethyl)-2-oxo-, methyl ester |
| CAS Registry Number |
112818-13-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H15IO3 |
| InChI |
InChI=1S/C10H15IO3/c1-14-9(13)10(7-11)6-4-2-3-5-8(10)12/h2-7H2,1H3 |
| InChIKey |
KJMKBDPWBMIJPH-UHFFFAOYSA-N |
| Molecular Weight |
310.131 g/mol |
| SMILES |
C1(C(=O)OC)(C(=O)CCCCC1)CI |
| SPLASH |
splash10-001i-0900000000-867dda701ad129870c5c |
| Source of Spectrum |
C-110-2572-34 |
| Synonyms |
Methyl 1-(iodomethyl)-2-oxocycloheptane-1-carboxylate
methyl 1-(iodomethyl)-2-oxocycloheptanecarboxylate |
| Wiley ID |
1310988 |
