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

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

ID: Reference10799

Other Names: NAT28-410236

Formula: C21H36N4O2

Spectral Data

2-[4-({(1S,4S,6S)-6-Isopropyl-3-methyl-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-cyclohexen-1-yl}methyl)-1-piperazinyl]ethanol 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 1255
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 8/27/2021 7:36:10 AM
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Identificators

InChI InChI=1S/C21H36N4O2/c1-15(2)20-12-18(13-21-23-22-17(4)27-21)16(3)11-19(20)14-25-7-5-24(6-8-25)9-10-26/h11,15,18-20,26H,5-10,12-14H2,1-4H3/t18-,19-,20-/m0/s1
InChI Key AORZHWVQPWCCCB-UFYCRDLUSA-N
Canonical SMILES CC1=CC(C(CC1CC2=NN=C(O2)C)C(C)C)CN3CCN(CC3)CCO
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Other Names NAT28-410236

In Other Databases

PubChem 45783880
ChemSpider 29849338