SpectraBase Spectrum ID |
8g0OSX2o1IW |
Name |
Methyl 11-(3-Azido-5-(azidomethyl)benzamido)-undecanoate |
Appearance |
Light brown solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
415.233187819 u |
Formula |
C20H29N7O3 |
InChI |
InChI=1S/C20H29N7O3/c1-30-19(28)10-8-6-4-2-3-5-7-9-11-23-20(29)17-12-16(15-24-26-21)13-18(14-17)25-27-22/h12-14H,2-11,15H2,1H3,(H,23,29) |
InChIKey |
ZVSRLPRUWJVOAW-UHFFFAOYSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/jo3026737 |
Molecular Weight |
415.498 g/mol |
Quality |
261 |
Reported Formula |
C20H29N7O3 |
SMILES |
N(CCCCCCCCCCC(OC)=O)C(C1=CC(=CC(=C1)CN=[N+]=[N-])N=[N+]=[N-])=O |
SPLASH |
splash10-066s-9726100000-9c889f660b2053b4b32b |
Source of Spectrum |
JOC-78-2460-20 (DOI: 10.1021/jo3026737) |
Thin-Layer Chromatography |
0.24 (cyclohexane/ethyl acetate, 3:1) |
Wiley ID |
1912374 |