1-Ethyl-3-{[(1S,4S,6S)-4-{[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl}-6-isopropyl-3-methyl-2-cyclohexen-1-yl]methyl}urea

enlarge

Systematic / IUPAC Name: 1-Ethyl-3-[[(1S,4S,6S)-4-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-methyl-6-propan-2-ylcyclohex-2-en-1-yl]methyl]urea

ID: Reference10547

Other Names: NAT28-417656

Formula: C23H31FN4O2

Spectral Data

1-Ethyl-3-{[(1S,4S,6S)-4-{[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl}-6-isopropyl-3-methyl-2-cyclohexen-1-yl]methyl}urea mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1865
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/11/2021 10:38:54 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C23H31FN4O2/c1-5-25-23(29)26-13-17-10-15(4)16(11-19(17)14(2)3)12-21-27-28-22(30-21)18-8-6-7-9-20(18)24/h6-10,14,16-17,19H,5,11-13H2,1-4H3,(H2,25,26,29)/t16-,17-,19-/m0/s1
InChI Key YRTLSSRRWILHKA-LNLFQRSKSA-N
Canonical SMILES CCNC(=O)NCC1C=C(C(CC1C(C)C)CC2=NN=C(O2)C3=CC=CC=C3F)C
CAS
Splash
Other Names NAT28-417656

In Other Databases

PubChem 45783945
ChemSpider 29849512