13C nuclear magnetic resonance spectroscopy (13C NMR)
URL: https://www.chemotion-repository.net/inchikey/KZXZGOZMJSZXPO-RRCQUFFISA-M/CHMO0000595
Dataset description:
dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)\n\n
Source: 13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Info
| InChI | InChI=1S/C48H38ClF26N2.ClH/c1-35(2)28-22-24(18-20-37(50,51)39(54,55)41(58,59)43(62,63)45(66,67)47(70,71)72)10-14-30(28)76(5)32(35)16-12-26-8-7-9-27(34(26)49)13-17-33-36(3,4)29-23-25(11-15-31(29)77(33)6)19-21-38(52,53)40(56,57)42(60,61)44(64,65)46(68,69)48(73,74)75;/h10-23H,7-9H2,1-6H3;1H/q+1;/p-1/b20-18+,21-19+; |
|---|---|
| SMILES | ClC1=C(CCC/C/1=C\C=C/1\N(C)c2c(C1(C)C)cc(cc2)/C=C/C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)/C=C/C1=[N+](C)c2c(C1(C)C)cc(cc2)/C=C/C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[Cl-] |
| InChI Key | OGJNIRVMBUQSNO-RRCQUFFISA-M |
| Molecular Formula | C48H38Cl2F26N2 |
| Exact Mass | 1207.693 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | September 7, 2024 |
| Metadata last updated | September 7, 2024 |
| Created | September 7, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | c605a2b1-3077-492a-96a3-99133a2d2d29 |
| Package id | 10-14272-kzxzgozmjszxpo-rrcquffisa-m-chmo0000595 |
| Resource type | HTML |
| State | active |