| SpectraBase Spectrum ID |
4p1Wvm9nuLf |
| Name |
Cycloheptanepentanoic acid, 1-nitro-.beta.,2-dioxo-, phenylmethyl ester |
| CAS Registry Number |
86572-31-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H23NO6 |
| InChI |
InChI=1S/C19H23NO6/c21-16(13-18(23)26-14-15-7-3-1-4-8-15)10-12-19(20(24)25)11-6-2-5-9-17(19)22/h1,3-4,7-8H,2,5-6,9-14H2 |
| InChIKey |
FQHZSSVPTZEKDF-UHFFFAOYSA-N |
| Molecular Weight |
361.394 g/mol |
| SMILES |
C1(N(=O)=O)(C(=O)CCCCC1)CCC(CC(=O)OCc1ccccc1)=O |
| SPLASH |
splash10-052f-9100000000-d13eb1ad6df75dab31cb |
| Source of Spectrum |
H-66-857-0 |
| Synonyms |
Benzyl 3-oxo-5-(1-nitro-2-oxocycloheptyl)pentanoate
benzyl 5-(1-nitro-2-oxocycloheptyl)-3-oxopentanoate |
| Wiley ID |
1348947 |
