(1S)-6-Amino-1,5-anhydro-2,3,6-trideoxy-1-{[5-(phenoxymethyl)-1,2-oxazol-3-yl]methyl}-D-erythro-hexitol

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Systematic / IUPAC Name: (2R,3S,6S)-2-(Aminomethyl)-6-[[5-(phenoxymethyl)-1,2-oxazol-3-yl]methyl]oxan-3-ol

ID: Reference12789

Other Names: D-Arabino-heptitol, 7-amino-2,6-anhydro-1,3,4,7-tetradeoxy-1-[5-(phenoxymethyl)-3-isoxazolyl]-;
NAT12-540628

Formula: C17H22N2O4

Spectral Data

(1S)-6-Amino-1,5-anhydro-2,3,6-trideoxy-1-{[5-(phenoxymethyl)-1,2-oxazol-3-yl]methyl}-D-erythro-hexitol 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 1250
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 9/29/2023 3:31:25 PM
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Identificators

InChI InChI=1S/C17H22N2O4/c18-10-17-16(20)7-6-14(22-17)8-12-9-15(23-19-12)11-21-13-4-2-1-3-5-13/h1-5,9,14,16-17,20H,6-8,10-11,18H2/t14-,16-,17+/m0/s1
InChI Key UGINPTMVRIHVFA-BHYGNILZSA-N
Canonical SMILES C1CC(C(OC1CC2=NOC(=C2)COC3=CC=CC=C3)CN)O
CAS
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Other Names D-Arabino-heptitol, 7-amino-2,6-anhydro-1,3,4,7-tetradeoxy-1-[5-(phenoxymethyl)-3-isoxazolyl]-;
NAT12-540628

In Other Databases

ChemSpider 29856624
PubChem 75366994