SpectraBase Spectrum ID |
4KTkMKAOh6 |
Name |
4-Nitro-12-carboxy[2.2]paracyclophane |
Alternate Name(s) |
11-nitrotricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaene-5-carboxylic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H15NO4 |
InChI |
InChI=1S/C17H15NO4/c19-17(20)15-9-11-1-5-13(15)6-2-12-4-8-14(7-3-11)16(10-12)18(21)22/h1,4-5,8-10H,2-3,6-7H2,(H,19,20) |
InChIKey |
YTSAVBSAAUFNDR-UHFFFAOYSA-N |
Molecular Weight |
297.310 g/mol |
SMILES |
OC(c1c2CCc3cc(N(=O)=O)c(cc3)CCc(c1)cc2)=O |
SPLASH |
splash10-0005-6930000000-739ffd74206eaebfb106 |
Source of Spectrum |
QC-8-3879-14 |
Wiley ID |
870291 |