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(1R,3R,4S,5R) 4-Acetoxy-3-benzyloxy-5-(1,2-diacetoxyethyl)-6,7,8-triazabicyclo[4.3.0.]non-1(9),7-dien
SpectraBase Compound ID 80nT4hRYAZW
InChI InChI=1S/C21H25N3O7/c1-13(25)28-12-19(30-14(2)26)20-21(31-15(3)27)18(9-17-10-22-23-24(17)20)29-11-16-7-5-4-6-8-16/h4-8,10,18-21H,9,11-12H2,1-3H3
InChIKey QNNLHEVWPUVESR-UHFFFAOYSA-N
Mol Weight 431.45 g/mol
Molecular Formula C21H25N3O7
Exact Mass 431.16925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bcp4iIJTyAb
Name (1R,3R,4S,5R) 4-Acetoxy-3-benzyloxy-5-(1,2-diacetoxyethyl)-6,7,8-triazabicyclo[4.3.0.]non-1(9),7-dien
Alternate Name(s) 2-(acetyloxy)-1-[6-(acetyloxy)-5-(benzyloxy)-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyridin-7-yl]ethyl acetate 4-Acetoxy-3-benzyloxy-5-(1,2-diacetoxyethyl)-6,7,8-triazabicyclo[4.3.0.]non-1(9)-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25N3O7
InChI InChI=1S/C21H25N3O7/c1-13(25)28-12-19(30-14(2)26)20-21(31-15(3)27)18(9-17-10-22-23-24(17)20)29-11-16-7-5-4-6-8-16/h4-8,10,18-21H,9,11-12H2,1-3H3
InChIKey QNNLHEVWPUVESR-UHFFFAOYSA-N
Molecular Weight 431.445 g/mol
SMILES C1([n]2c(CC(C1OC(=O)C)OCc1ccccc1)cnn2)C(OC(=O)C)COC(=O)C
SPLASH splash10-00kf-9381000000-84d28b40acb2f175bac6
Source of Spectrum J-66-3724-54
Wiley ID 1535253