3. Structures
3.1 2D structure
3.2 3D structure
-1
-2
-3
40 43 0 0 0 0 0 0 0999 V2000
-0.2098 0.0014 0.6579 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1100 -0.0187 -0.4848 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7828 2.3144 -0.5557 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8633 -2.2937 -0.4901 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1988 0.0877 1.8187 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5214 0.0062 -0.4448 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0043 0.0044 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4487 1.1692 0.6819 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3879 -1.1885 0.6909 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0260 0.6938 -0.5173 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9885 -0.7527 -0.5118 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5151 0.0442 1.8741 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3593 2.5259 0.9481 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2289 -2.5366 0.9678 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5110 1.5794 -1.4659 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4275 -1.6694 -1.4532 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8482 3.4178 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6711 -3.4600 0.0187 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4176 2.9494 -1.2037 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2639 -3.0307 -1.1804 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6710 0.8099 -0.3825 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6977 -0.7200 -0.3607 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2141 1.1746 -0.4773 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2545 -1.1377 -0.4444 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5745 0.0296 0.7674 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6065 -0.0047 2.4713 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2637 0.9604 2.4218 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2386 -0.8191 2.4916 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9246 2.8920 1.8717 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7759 -2.8724 1.8941 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9552 1.2330 -2.3931 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8891 -1.3535 -2.3828 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7897 4.4876 0.1739 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5575 -4.5240 0.2088 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7919 3.6628 -1.9333 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6009 -3.7681 -1.9043 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0989 1.2280 0.5334 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2090 1.2039 -1.2497 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2497 -1.1194 -1.2164 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1392 -1.0964 0.5667 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 1 0 0 0 0
1 25 1 0 0 0 0
2 6 1 0 0 0 0
2 25 1 0 0 0 0
3 23 2 0 0 0 0
4 24 2 0 0 0 0
5 25 2 0 0 0 0
6 23 1 0 0 0 0
6 24 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 12 1 0 0 0 0
7 26 1 0 0 0 0
8 10 1 0 0 0 0
8 13 2 0 0 0 0
9 11 1 0 0 0 0
9 14 2 0 0 0 0
10 11 1 0 0 0 0
10 15 2 0 0 0 0
11 16 2 0 0 0 0
12 27 1 0 0 0 0
12 28 1 0 0 0 0
13 17 1 0 0 0 0
13 29 1 0 0 0 0
14 18 1 0 0 0 0
14 30 1 0 0 0 0
15 19 1 0 0 0 0
15 31 1 0 0 0 0
16 20 1 0 0 0 0
16 32 1 0 0 0 0
17 19 2 0 0 0 0
17 33 1 0 0 0 0
18 20 2 0 0 0 0
18 34 1 0 0 0 0
19 35 1 0 0 0 0
20 36 1 0 0 0 0
21 22 1 0 0 0 0
21 23 1 0 0 0 0
21 37 1 0 0 0 0
21 38 1 0 0 0 0
22 24 1 0 0 0 0
22 39 1 0 0 0 0
22 40 1 0 0 0 0
4. International Nomenclature & Identifiers
4.1 IUPAC Name
(2,5-dioxopyrrolidin-1-yl) 9H-fluoren-9-ylmethyl carbonate
4.2 InChI
InChI=1S/C19H15NO5/c21-17-9-10-18(22)20(17)25-19(23)24-11-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,16H,9-11H2
4.3 InChIKey
WMSUFWLPZLCIHP-UHFFFAOYSA-N
4.4 Canonical SMILES
C1CC(=O)N(C1=O)OC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
4.5 Isomeric SMILES
-
4.6 SDF file
5. Spectroscopic data
5.1 13C nuclear magnetic resonance (13C NMR)
5.2 1H nuclear magnetic resonance (1H NMR)
5.3 Mass spectrometry (MS)
5.4 Infrared spectroscopy (IR)
5.5 Ultraviolet/visible spectroscopy (UV/Vis)
