| SpectraBase Spectrum ID |
JIlVAzkESqI |
| Name |
2-{4-[(4'-Chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-yl)methyl]piperazine-1-carbonyl}benzaldehyde |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H31ClN2O2 |
| InChI |
InChI=1S/C27H31ClN2O2/c1-27(2)12-11-21(25(17-27)20-7-9-23(28)10-8-20)18-29-13-15-30(16-14-29)26(32)24-6-4-3-5-22(24)19-31/h3-10,19H,11-18H2,1-2H3 |
| InChIKey |
MDSYPPUSVHCRRU-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/adsc.202200190 |
| Molecular Weight |
451.010 g/mol |
| Reported Formula |
C27H31ClN2O2 |
| SMILES |
c1(Cl)ccc(cc1)C1=C(CCC(C1)(C)C)CN1CCN(CC1)C(=O)c1c(cccc1)C=O |
| SPLASH |
splash10-0udi-1630900000-773c83e3fd869ffba0b2 |
| Source of Spectrum |
ASC-364-SM14-5ax |
| Wiley ID |
1868660 |
![2-{4-[(4'-Chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-yl)methyl]piperazine-1-carbonyl}benzaldehyde](/api/spectrum/JIlVAzkESqI/structure.png?h=300&w=458 "2-{4-[(4'-Chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-yl)methyl]piperazine-1-carbonyl}benzaldehyde")
