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Pyrrolo[2,1-b][1,3]oxazepin-7(9aH)-one, 9-azido-8-chloro-2,3,4,5-tetrahydro-
SpectraBase Compound ID JoEua4MQhfC
InChI InChI=1S/C8H9ClN4O2/c9-5-6(11-12-10)8-13(7(5)14)3-1-2-4-15-8/h8H,1-4H2
InChIKey NRPIQLZWVUHHAC-UHFFFAOYSA-N
Mol Weight 228.64 g/mol
Molecular Formula C8H9ClN4O2
Exact Mass 228.041403 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 77p5X5V6UvC
Name Pyrrolo[2,1-b][1,3]oxazepin-7(9aH)-one, 9-azido-8-chloro-2,3,4,5-tetrahydro-
CAS Registry Number 76834-36-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9ClN4O2
InChI InChI=1S/C8H9ClN4O2/c9-5-6(11-12-10)8-13(7(5)14)3-1-2-4-15-8/h8H,1-4H2
InChIKey NRPIQLZWVUHHAC-UHFFFAOYSA-N
Molecular Weight 228.639 g/mol
SMILES C1(=C(C(=O)N2C1OCCCC2)Cl)N=[N+]=[N-]
SPLASH splash10-0fb9-0090000000-16910653d27e831df8c3
Source of Spectrum C-103-1774-0
Synonyms 7-Azido-8-chloro-5-oxa-9-oxo-1-azabicyclo[4.3.0]non-7-ene 9-Azido-8-chloro-2,3,4,5-tetrahydropyrrolo[2,1-b][1,3]oxazepin-7(9aH)-one
Wiley ID 97737