2-{[(3-{[5-(Phenoxymethyl)-1,2-oxazol-3-yl]methyl}-3-oxetanyl)amino]methyl}phenol

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Systematic / IUPAC Name: 2-[[[3-[[5-(Phenoxymethyl)-1,2-oxazol-3-yl]methyl]oxetan-3-yl]amino]methyl]phenol

ID: Reference11716

Other Names: NAT39-500447

Formula: C21H22N2O4

Spectral Data

2-{[(3-{[5-(Phenoxymethyl)-1,2-oxazol-3-yl]methyl}-3-oxetanyl)amino]methyl}phenol 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 1114
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 9/6/2022 7:25:15 AM
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Identificators

InChI InChI=1S/C21H22N2O4/c24-20-9-5-4-6-16(20)12-22-21(14-25-15-21)11-17-10-19(27-23-17)13-26-18-7-2-1-3-8-18/h1-10,22,24H,11-15H2
InChI Key KRKZJLHWCZPSBW-UHFFFAOYSA-N
Canonical SMILES C1C(CO1)(CC2=NOC(=C2)COC3=CC=CC=C3)NCC4=CC=CC=C4O
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Other Names NAT39-500447

In Other Databases

ChemSpider 29853628
PubChem 56775665