2-(4-{[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(2-methyl-2-propanyl)-1,3,4-oxadiazol-2-yl]methyl}-2-cyclohexen-1-yl]methyl}-1-piperazinyl)pyrazine

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Systematic / IUPAC Name: 2-tert-Butyl-5-[[(1S,4S,5S)-2-methyl-5-propan-2-yl-4-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]cyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazole

ID: Reference12652

Other Names: NAT28-414678

Formula: C26H40N6O

Spectral Data

2-(4-{[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(2-methyl-2-propanyl)-1,3,4-oxadiazol-2-yl]methyl}-2-cyclohexen-1-yl]methyl}-1-piperazinyl)pyrazine 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 910
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 7/14/2023 9:43:24 AM
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Identificators

InChI InChI=1S/C26H40N6O/c1-18(2)22-14-20(15-24-29-30-25(33-24)26(4,5)6)19(3)13-21(22)17-31-9-11-32(12-10-31)23-16-27-7-8-28-23/h7-8,13,16,18,20-22H,9-12,14-15,17H2,1-6H3/t20-,21-,22-/m0/s1
InChI Key HGTDLLIVIZPEJA-FKBYEOEOSA-N
Canonical SMILES CC1=CC(C(CC1CC2=NN=C(O2)C(C)(C)C)C(C)C)CN3CCN(CC3)C4=NC=CN=C4
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Other Names NAT28-414678

In Other Databases

PubChem 45784113
ChemSpider 29849456