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

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Systematic / IUPAC Name: (4aR,7aS)-6-(Cyclopropanecarbonyl)-4-(pyridin-3-ylmethyl)-4a,5,7,7a-tetrahydropyrrolo[3,4-b][1,4]oxazin-3-one

ID: Reference9660

Other Names: Pyrrolo[3,4-b]-1,4-oxazin-3(2H)-one, 6-(cyclopropylcarbonyl)hexahydro-4-(3-pyridinylmethyl)-, (4aR,7aS)-;
NAT37-510458

Formula: C16H19N3O3

Spectral Data

(4aR,7aS)-6-(Cyclopropylcarbonyl)-4-(3-pyridinylmethyl)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 535
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 4/30/2020 6:15:06 PM
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Identificators

InChI InChI=1S/C16H19N3O3/c20-15-10-22-14-9-18(16(21)12-3-4-12)8-13(14)19(15)7-11-2-1-5-17-6-11/h1-2,5-6,12-14H,3-4,7-10H2/t13-,14+/m1/s1
InChI Key DZISMEFODFGNKW-KGLIPLIRSA-N
Canonical SMILES C1CC1C(=O)N2CC3C(C2)OCC(=O)N3CC4=CN=CC=C4
CAS
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Other Names Pyrrolo[3,4-b]-1,4-oxazin-3(2H)-one, 6-(cyclopropylcarbonyl)hexahydro-4-(3-pyridinylmethyl)-, (4aR,7aS)-;
NAT37-510458

In Other Databases

PubChem 56775241
ChemSpider 29852396