2-(4-{[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(4-pyridinyl)-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-6-propan-2-yl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]piperazin-1-yl]ethanol

ID: Reference9633

Other Names: 1-Piperazineethanol, 4-[[(1S,4S,6S)-3-methyl-6-(1-methylethyl)-4-[[5-(4-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]-2-cyclohexen-1-yl]methyl]-;
NAT28-411244

Formula: C25H37N5O2

Spectral Data

2-(4-{[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(4-pyridinyl)-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 1529
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 4/24/2020 12:47:17 PM
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Identificators

InChI InChI=1S/C25H37N5O2/c1-18(2)23-15-21(16-24-27-28-25(32-24)20-4-6-26-7-5-20)19(3)14-22(23)17-30-10-8-29(9-11-30)12-13-31/h4-7,14,18,21-23,31H,8-13,15-17H2,1-3H3/t21-,22-,23-/m0/s1
InChI Key VAABRQRSPVXVNN-VABKMULXSA-N
Canonical SMILES CC1=CC(C(CC1CC2=NN=C(O2)C3=CC=NC=C3)C(C)C)CN4CCN(CC4)CCO
CAS
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Other Names 1-Piperazineethanol, 4-[[(1S,4S,6S)-3-methyl-6-(1-methylethyl)-4-[[5-(4-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]-2-cyclohexen-1-yl]methyl]-;
NAT28-411244

In Other Databases

PubChem 45783914
ChemSpider 29849363