(4aR,7aS)-4-(4-Fluorobenzyl)-6-(phenoxyacetyl)hexahydropyrrolo[3,4-b][1,4]oxazin-3(2H)-one

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Systematic / IUPAC Name: (4aR,7aS)-4-[(4-Fluorophenyl)methyl]-6-(2-phenoxyacetyl)-4a,5,7,7a-tetrahydropyrrolo[3,4-b][1,4]oxazin-3-one

ID: Reference10754

Other Names: Pyrrolo[3,4-b]-1,4-oxazin-3(2H)-one, 4-[(4-fluorophenyl)methyl]hexahydro-6-(2-phenoxyacetyl)-, (4aR,7aS)-;
NAT37-510673

Formula: C21H21FN2O4

Spectral Data

(4aR,7aS)-4-(4-Fluorobenzyl)-6-(phenoxyacetyl)hexahydropyrrolo[3,4-b][1,4]oxazin-3(2H)-one 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 1430
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 8/13/2021 5:58:55 AM
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Identificators

InChI InChI=1S/C21H21FN2O4/c22-16-8-6-15(7-9-16)10-24-18-11-23(12-19(18)28-14-21(24)26)20(25)13-27-17-4-2-1-3-5-17/h1-9,18-19H,10-14H2/t18-,19+/m1/s1
InChI Key NTFHMJRFKYAPII-MOPGFXCFSA-N
Canonical SMILES C1C2C(CN1C(=O)COC3=CC=CC=C3)OCC(=O)N2CC4=CC=C(C=C4)F
CAS
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Other Names Pyrrolo[3,4-b]-1,4-oxazin-3(2H)-one, 4-[(4-fluorophenyl)methyl]hexahydro-6-(2-phenoxyacetyl)-, (4aR,7aS)-;
NAT37-510673

In Other Databases

ChemSpider 29852433
PubChem 56775278