| SpectraBase Spectrum ID |
HrC2vMynwOA |
| Name |
2-(3-azidopropyl)-2-(benzo[d][1,3]dioxol-5-ylmethyl)cyclohexane-1,3-dione |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
329.137556100 u |
| Formula |
C17H19N3O4 |
| InChI |
InChI=1S/C17H19N3O4/c18-20-19-8-2-7-17(15(21)3-1-4-16(17)22)10-12-5-6-13-14(9-12)24-11-23-13/h5-6,9H,1-4,7-8,10-11H2 |
| InChIKey |
JXDBWUKYALLWBR-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMSQP2010SE |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202107909 |
| Molecular Weight |
329.356 g/mol |
| Quality |
113 |
| SMILES |
C1(C(C(CCC1)=O)(CCCN=[N+]=[N-])CC1=CC2=C(C=C1)OCO2)=O |
| SPLASH |
splash10-014r-0900000000-fa5fd1f5a6965f4cff25 |
| Source of Spectrum |
ACI-60-SM34-1d (DOI: 10.1002/anie.202107909) |
| Wiley ID |
1891340 |
![2-(3-azidopropyl)-2-(benzo[d][1,3]dioxol-5-ylmethyl)cyclohexane-1,3-dione](/api/spectrum/HrC2vMynwOA/structure.png?h=300&w=458 "2-(3-azidopropyl)-2-(benzo[d][1,3]dioxol-5-ylmethyl)cyclohexane-1,3-dione")
