SpectraBase Spectrum ID |
GqLpGrzwulU |
Name |
2-[3-(Acetyloxy)ethyl-1-oxoisoquinolin-2(1H)-yl]-pyridine-2-oxide |
Appearance |
White solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
310.095356935 u |
Formula |
C17H14N2O4 |
InChI |
InChI=1S/C17H14N2O4/c1-12(20)23-11-14-10-13-6-2-3-7-15(13)17(21)19(14)16-8-4-5-9-18(16)22/h2-10H,11H2,1H3 |
InChIKey |
AMJHPQQOHYUPFM-UHFFFAOYSA-N |
Instrument Name |
Finnigan MAT 95 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.201712647 |
Molecular Weight |
310.309 g/mol |
Quality |
139 |
Reported Formula |
C17H14N2O4 |
SMILES |
C12=C(C=C(N(C2=O)C=2[N+](=CC=CC2)[O-])COC(=O)C)C=CC=C1 |
SPLASH |
splash10-0v0r-2191000000-d970b7da3e1b03e683c2 |
Source of Spectrum |
ACI-57-SM22-3ak (DOI: 10.1002/anie.201712647) |
Wiley ID |
1891213 |