| SpectraBase Spectrum ID |
9LA1AHfYhc2 |
| Name |
Heptanoic acid, 6-nitro-3-oxo-2-(1-oxopropyl)-, methyl ester |
| Alternate Name(s) |
Methyl 6-nitro-3-oxo-2-propionylheptanoate
Methylester of 6-nitro-3-oxo-2-propionyl-heptanoic acid |
| CAS Registry Number |
80213-51-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H17NO6 |
| InChI |
InChI=1S/C11H17NO6/c1-4-8(13)10(11(15)18-3)9(14)6-5-7(2)12(16)17/h7,10H,4-6H2,1-3H3 |
| InChIKey |
YZNXBWHHAAQXGD-UHFFFAOYSA-N |
| Molecular Weight |
259.258 g/mol |
| SMILES |
C(N(=O)=O)(CCC(C(C(=O)OC)C(=O)CC)=O)C |
| SPLASH |
splash10-0a4i-9000000000-853e32cd6fb22dc59315 |
| Source of Spectrum |
H-64-1863-0 |
| Wiley ID |
1262515 |
