SpectraBase Spectrum ID |
621ZgJ6U1Ol |
Name |
3-methyl-1,5-dinitro-2,3,4,5-tetrahydro-1,5-methanobenzo[d]azocin-6(1H)-one |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
291.085520526 u |
Formula |
C13H13N3O5 |
InChI |
InChI=1S/C13H13N3O5/c1-14-7-12(15(18)19)6-13(8-14,16(20)21)11(17)9-4-2-3-5-10(9)12/h2-5H,6-8H2,1H3 |
InChIKey |
BUKRPEDOSMOQEB-UHFFFAOYSA-N |
Molecular Weight |
291.263 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_17253 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10322362; Lab Info: ATR; Lab Number: ATR-EN00004 |