SpectraBase Spectrum ID |
84xJEoUTTd5 |
Name |
4-azido-3-tert-butyl-benzonitrile |
Appearance |
Dark yellow solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
200.106196402 u |
Formula |
C11H12N4 |
InChI |
InChI=1S/C11H12N4/c1-11(2,3)9-6-8(7-12)4-5-10(9)14-15-13/h4-6H,1-3H3 |
InChIKey |
VYOFQOYSOHPXHZ-UHFFFAOYSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.201704260 |
Molecular Weight |
200.245 g/mol |
Quality |
38 |
Reported Formula |
C11H12N4 |
SMILES |
C1(=CC(=C(C=C1)N=[N+]=[N-])C(C)(C)C)C#N |
SPLASH |
splash10-0a4i-0910000000-d3fe6216f99ed80b44c0 |
Source of Spectrum |
ACI-56-SM32-13 (DOI: 10.1002/anie.201704260) |
Thin-Layer Chromatography |
0.76 (petroleum ether/ethyl acetate, 6:1) |
Wiley ID |
1896288 |