1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/LWKAZZLXGDNWMV-UHFFFAOYSA-N/CHMO0000593
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
| InChI | InChI=1S/C64H20F28N8.Zn/c65-41-17-37-38(18-42(41)66)51-93-49(37)95-53-45-33(21-5-25(57(69,70)71)13-26(6-21)58(72,73)74)1-2-34(22-7-27(59(75,76)77)14-28(8-22)60(78,79)80)46(45)54(99-53)96-50-39-19-43(67)44(68)20-40(39)52(94-50)98-56-48-36(24-11-31(63(87,88)89)16-32(12-24)64(90,91)92)4-3-35(47(48)55(97-51)100-56)23-9-29(61(81,82)83)15-30(10-23)62(84,85)86;/h1-20H;/q-2;+2 |
|---|---|
| SMILES | Fc1cc2/C/3=N/c4c5c(ccc(c5c5n4[Zn]n4/c(=N\C(=N3)c2cc1F)/c1c(ccc(c1/c/4=N/C1=N/C(=N\5)/c2cc(F)c(cc12)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F |
| InChI Key | LWKAZZLXGDNWMV-UHFFFAOYSA-N |
| Molecular Formula | C64H20F28N8Zn |
| Exact Mass | 1498.232 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | March 9, 2025 |
| Metadata last updated | March 9, 2025 |
| Created | March 9, 2025 |
| Format | HTML |
| License | No License Provided |
| Id | 34685256-7c74-491c-9e94-092200e6af8f |
| Package id | 10-14272-lwkazzlxgdnwmv-uhfffaoysa-n-chmo0000593 |
| Resource type | HTML |
| State | active |