Systematic / IUPAC Name: (1R,2S,3R,4R)-3-[(4-Methoxyphenyl)methylamino]-4-[4-(trifluoromethyl)phenyl]cyclopentane-1,2-diol
ID: Reference10874
Other Names:
1,2-Cyclopentanediol, 3-[[(4-methoxyphenyl)methyl]amino]-4-[4-(trifluoromethyl)phenyl]-, (1R,2S,3R,4R)-;
NAT38-539602
Formula: C20H22F3NO3
(1R,2S,3R,4R)-3-[(4-Methoxybenzyl)amino]-4-[4-(trifluoromethyl)phenyl]-1,2-cyclopentanediol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 405 |
Tandem Spectra | MS1, MS2, MS3 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 9/23/2021 7:43:02 AM |
InChI | InChI=1S/C20H22F3NO3/c1-27-15-8-2-12(3-9-15)11-24-18-16(10-17(25)19(18)26)13-4-6-14(7-5-13)20(21,22)23/h2-9,16-19,24-26H,10-11H2,1H3/t16-,17-,18-,19-/m1/s1 |
InChI Key | QLCMTZUVRMJWDV-NCXUSEDFSA-N |
Canonical SMILES | COC1=CC=C(C=C1)CNC2C(CC(C2O)O)C3=CC=C(C=C3)C(F)(F)F |
CAS | |
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Other Names |
1,2-Cyclopentanediol, 3-[[(4-methoxyphenyl)methyl]amino]-4-[4-(trifluoromethyl)phenyl]-, (1R,2S,3R,4R)-; NAT38-539602 |