1-[(1S,4S,6S)-4-{[5-(2-Fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl}-6-isopropyl-3-methyl-2-cyclohexen-1-yl]-N-(2-pyridinylmethyl)methanamine

Systematic / IUPAC Name: 1-[(1S,4S,6S)-4-[[5-(2-Fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-methyl-6-propan-2-ylcyclohex-2-en-1-yl]-N-(pyridin-2-ylmethyl)methanamine

ID: Reference12185

Other Names: NAT28-414519

Formula: C26H31FN4O

Spectral Data

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

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1434
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 1/27/2023 9:19:23 AM
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Identificators

InChI InChI=1S/C26H31FN4O/c1-17(2)23-13-19(14-25-30-31-26(32-25)22-9-4-5-10-24(22)27)18(3)12-20(23)15-28-16-21-8-6-7-11-29-21/h4-12,17,19-20,23,28H,13-16H2,1-3H3/t19-,20-,23-/m0/s1
InChI Key KTFYHSPKPJAARM-JTAQYXEDSA-N
Canonical SMILES CC1=CC(C(CC1CC2=NN=C(O2)C3=CC=CC=C3F)C(C)C)CNCC4=CC=CC=N4
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Other Names NAT28-414519

In Other Databases

ChemSpider 22937537
PubChem 38031080