| SpectraBase Spectrum ID |
2nxdw1HlTXM |
| Name |
Isobutyl nitrate |
| CAS Registry Number |
543-29-3 |
| Classification |
Poppers |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
119.058243151 u |
| Formula |
C4H9NO3 |
| InChI |
InChI=1S/C4H9NO3/c1-4(2)3-8-5(6)7/h4H,3H2,1-2H3 |
| InChIKey |
LNNXFUZKZLXPOF-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
119.120 g/mol |
| Nominal Mass |
119 u |
| Quality |
1000 |
| Retention Index |
867 |
| SMILES |
C(ON(=O)=O)C(C)C |
| SPLASH |
splash10-0006-9000000000-b4222f649afdb83eaf3f |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Nitric acid 2-methylpropyl ester
Nitric acid isobutyl ester |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009774 |
