| SpectraBase Spectrum ID |
A4RLouMtFOx |
| Name |
N-acetyl-beta-alanine, 1TMS |
| Alternate Name(s) |
N-Acetyl-beta-alanine, 1TMS
3-Acetamidopropanoic acid, 1TMS
3-(acetylamino)propanoic acid, 1TMS
CHEBI:16682, 1TMS
NSC32039, 1TMS
EINECS 221-185-6, 1TMS
3-Acetamidopropanoic acid, 1TMS
Trimethylsilyl 3-acetamidopropanoate |
| Comments |
Derivatization type: 1 TMS (mass: 203.098); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000680; Note: The molecular formula of the structure shown is C5H9NO3 - which differs from the formula reported for the mass spectrum (C8H17NO3Si) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H17NO3Si |
| InChI |
InChI=1S/C8H17NO3Si/c1-7(10)9-6-5-8(11)12-13(2,3)4/h5-6H2,1-4H3,(H,9,10) |
| InChIKey |
IRDMKLNLBHOFTE-UHFFFAOYSA-N |
| Molecular Weight |
203.313 g/mol |
| SMILES |
N(CCC(=O)O[Si](C)(C)C)C(C)=O |
| SPLASH |
splash10-00p0-2900000000-9c661887d9223e8ca5f1 |
| Source of Spectrum |
FM-2019-680-0 |
| Wiley ID |
1818358 |
