| SpectraBase Spectrum ID |
BaNTitY8iG6 |
| Name |
N-acetylisatin, 3TMS |
| Alternate Name(s) |
N-Acetylisatin, 3TMS
Acetylisatin, 3TMS
1-Acetylisatin, 3TMS
1-Acetyl-indole-2,3-dione, 3TMS
1-Acetyl-1H-indole-2,3-dione, 3TMS
1H-Indole-2,3-dione, 1-acetyl-, 3TMS
1-Acetylindole-2,3-dione, 3TMS
1-Acetylindoline-2,3-dione |
| Comments |
Non-derivatized structure shown; Derivatization type: 3 TMS (mass: 405.161); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000046; Note: The molecular formula of the structure shown is C10H7NO3 - which differs from the formula reported for the mass spectrum (C19H31NO3Si3) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H31NO3Si3 |
| InChI |
InChI=1S/C10H7NO3/c1-6(12)11-8-5-3-2-4-7(8)9(13)10(11)14/h2-5H,1H3 |
| InChIKey |
LPGDEHBASRKTDG-UHFFFAOYSA-N |
| Molecular Weight |
189.170 g/mol |
| SMILES |
CC(N1c2ccccc2C(C1=O)=O)=O |
| SPLASH |
splash10-00ko-4930000000-5789f35c9365fb65125e |
| Source of Spectrum |
FM-2019-46-0 |
| Wiley ID |
1817747 |
