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)ethanol

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

ID: Reference12350

Other Names: NAT28-412028

Formula: C27H40N4O2

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)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 1591
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/7/2023 12:41:51 PM
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Identificators

InChI InChI=1S/C27H40N4O2/c1-19(2)25-16-23(17-26-28-29-27(33-26)22-7-5-20(3)6-8-22)21(4)15-24(25)18-31-11-9-30(10-12-31)13-14-32/h5-8,15,19,23-25,32H,9-14,16-18H2,1-4H3/t23-,24-,25-/m0/s1
InChI Key VFAANDPJNGONEO-SDHOMARFSA-N
Canonical SMILES CC1=CC=C(C=C1)C2=NN=C(O2)CC3CC(C(C=C3C)CN4CCN(CC4)CCO)C(C)C
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Other Names NAT28-412028

In Other Databases

PubChem 38030637
ChemSpider 22937470