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(5-methoxy-7-nitro-1-oxido-1,2,4-benzotriazin-1-ium-3-yl)amine
SpectraBase Compound ID 4g4wqXTLQxs
InChI InChI=1S/C8H7N5O4/c1-17-6-3-4(13(15)16)2-5-7(6)10-8(9)11-12(5)14/h2-3H,1H3,(H2,9,10,11)
InChIKey ALBJLFPPBVPROU-UHFFFAOYSA-N
Mol Weight 237.18 g/mol
Molecular Formula C8H7N5O4
Exact Mass 237.049804 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9dWufOaclDZ
Name (5-methoxy-7-nitro-1-oxido-1,2,4-benzotriazin-1-ium-3-yl)amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7N5O4
InChI InChI=1S/C8H7N5O4/c1-17-6-3-4(13(15)16)2-5-7(6)10-8(9)11-12(5)14/h2-3H,1H3,(H2,9,10,11)
InChIKey ALBJLFPPBVPROU-UHFFFAOYSA-N
Molecular Weight 237.175 g/mol
SMILES Nc1n[n+](c2c(c(OC)cc(N(=O)=O)c2)n1)[O-]
SPLASH splash10-0a5i-0890000000-e2f0f8045b7af03ec9f2
Source of Spectrum QF-49-1641-4
Synonyms 5-Methoxy-7-nitro-1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-amine 5-Methoxy-7-nitro-1-oxido-1,2,4-benzotriazin-1-ium-3-amine
Wiley ID 1547963