1-(4-{[3-({5-[(Dimethylamino)methyl]-1,2-oxazol-3-yl}methyl)-3-oxetanyl]amino}-1-piperidinyl)ethanone

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Systematic / IUPAC Name: 1-[4-[[3-[[5-[(Dimethylamino)methyl]-1,2-oxazol-3-yl]methyl]oxetan-3-yl]amino]piperidin-1-yl]ethanone

ID: Reference9657

Other Names: Ethanone, 1-[4-[[3-[[5-[(dimethylamino)methyl]-3-isoxazolyl]methyl]-3-oxetanyl]amino]-1-piperidinyl]-;
NAT39-499969

Formula: C17H28N4O3

Spectral Data

1-(4-{[3-({5-[(Dimethylamino)methyl]-1,2-oxazol-3-yl}methyl)-3-oxetanyl]amino}-1-piperidinyl)ethanone 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 1861
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods NSI
Analyzers FT
Last Modification 4/30/2020 6:10:56 PM
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Identificators

InChI InChI=1S/C17H28N4O3/c1-13(22)21-6-4-14(5-7-21)18-17(11-23-12-17)9-15-8-16(24-19-15)10-20(2)3/h8,14,18H,4-7,9-12H2,1-3H3
InChI Key UDIPLAYWDMWKTH-UHFFFAOYSA-N
Canonical SMILES CC(=O)N1CCC(CC1)NC2(COC2)CC3=NOC(=C3)CN(C)C
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Other Names Ethanone, 1-[4-[[3-[[5-[(dimethylamino)methyl]-3-isoxazolyl]methyl]-3-oxetanyl]amino]-1-piperidinyl]-;
NAT39-499969

In Other Databases

ChemSpider 29853399
PubChem 56775426
ChEMBL CHEMBL3437124