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

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Systematic / IUPAC Name: 2-(4-Methylphenyl)-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: Reference12089

Other Names: NAT28-412102

Formula: C29H38N6O

Spectral Data

2-(4-{[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(4-methylphenyl)-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 1300
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 1/2/2023 3:49:39 PM
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Identificators

InChI InChI=1S/C29H38N6O/c1-20(2)26-16-24(17-28-32-33-29(36-28)23-7-5-21(3)6-8-23)22(4)15-25(26)19-34-11-13-35(14-12-34)27-18-30-9-10-31-27/h5-10,15,18,20,24-26H,11-14,16-17,19H2,1-4H3/t24-,25-,26-/m0/s1
InChI Key OMCOOGRRVQREFU-GSDHBNRESA-N
Canonical SMILES CC1=CC=C(C=C1)C2=NN=C(O2)CC3CC(C(C=C3C)CN4CCN(CC4)C5=NC=CN=C5)C(C)C
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Other Names NAT28-412102

In Other Databases

ChemSpider 29849377
PubChem 45783937