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3-Aza-2-azoniabicyclo[2.2.1]hept-2-ene, 2-[(methoxycarbonyl)amino]-, hydroxide, inner salt
SpectraBase Compound ID HdPhk6OkJyy
InChI InChI=1S/C7H11N3O2/c1-12-7(11)9-10-6-3-2-5(4-6)8-10/h5-6H,2-4H2,1H3
InChIKey CPTXQEHFGJKONE-UHFFFAOYSA-N
Mol Weight 169.18 g/mol
Molecular Formula C7H11N3O2
Exact Mass 169.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID b41cK381Kc
Name 3-Aza-2-azoniabicyclo[2.2.1]hept-2-ene, 2-[(methoxycarbonyl)amino]-, hydroxide, inner salt
CAS Registry Number 82317-32-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11N3O2
InChI InChI=1S/C7H11N3O2/c1-12-7(11)9-10-6-3-2-5(4-6)8-10/h5-6H,2-4H2,1H3
InChIKey CPTXQEHFGJKONE-UHFFFAOYSA-N
Molecular Weight 169.184 g/mol
SMILES C([N-][N+]1=NC2CC1CC2)(=O)OC
SPLASH splash10-0aou-9100000000-bac9314d1bc53555a106
Source of Spectrum H-65-226-0
Wiley ID 1165636