| SpectraBase Spectrum ID |
BLBR1RZjKm5 |
| Name |
4-Nitro-benzoic acid, 1-deuterio1-methyl-heptyl ester |
| Alternate Name(s) |
1-Deuterio 1-methylheptyl 4-nitrobenzoate
4-Nitrobenzoic acid 1-deuterio 1-methylheptyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H20DNO4 |
| InChI |
InChI=1S/C15H21NO4/c1-3-4-5-6-7-12(2)20-15(17)13-8-10-14(11-9-13)16(18)19/h8-12H,3-7H2,1-2H3/i12D |
| InChIKey |
BGMDLHOQWYCYBI-UQBWLURTSA-N |
| Molecular Weight |
280.342 g/mol |
| SMILES |
c1([N+]([O-])=O)ccc(C(OC([D])(CCCCCC)C)=O)cc1 |
| SPLASH |
splash10-0udl-9500000000-fcca20efe9fe528eb7d2 |
| Wiley ID |
1484258 |
