2-[(3R,4S)-3-({5-[(Phenylsulfanyl)methyl]-1,2-oxazol-3-yl}methyl)-4-piperidinyl]-1-(1-piperidinyl)ethanone

enlarge

Systematic / IUPAC Name: 2-[(3R,4S)-3-[[5-(Phenylsulfanylmethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-yl]-1-piperidin-1-ylethanone

ID: Reference9462

Other Names: Ethanone, 2-[(3R,4S)-3-[[5-[(phenylthio)methyl]-3-isoxazolyl]methyl]-4-piperidinyl]-1-(1-piperidinyl)-;
NAT14-350176

Formula: C23H31N3O2S

Spectral Data

2-[(3R,4S)-3-({5-[(Phenylsulfanyl)methyl]-1,2-oxazol-3-yl}methyl)-4-piperidinyl]-1-(1-piperidinyl)ethanone mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 936
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 3/11/2020 9:43:13 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C23H31N3O2S/c27-23(26-11-5-2-6-12-26)14-18-9-10-24-16-19(18)13-20-15-21(28-25-20)17-29-22-7-3-1-4-8-22/h1,3-4,7-8,15,18-19,24H,2,5-6,9-14,16-17H2/t18-,19-/m0/s1
InChI Key UZMYMTUXMIIKEQ-OALUTQOASA-N
Canonical SMILES C1CCN(CC1)C(=O)CC2CCNCC2CC3=NOC(=C3)CSC4=CC=CC=C4
CAS
Splash
Other Names Ethanone, 2-[(3R,4S)-3-[[5-[(phenylthio)methyl]-3-isoxazolyl]methyl]-4-piperidinyl]-1-(1-piperidinyl)-;
NAT14-350176

In Other Databases

ChemSpider 21384902
PubChem 26743116