| SpectraBase Spectrum ID |
1qJnFrMlrd |
| Name |
[1-(Tert-butoxycarbonyl)indolin-7-yl]acetaldehyde |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.136493473 u |
| Formula |
C15H19NO3 |
| InChI |
InChI=1S/C15H19NO3/c1-15(2,3)19-14(18)16-9-7-11-5-4-6-12(8-10-17)13(11)16/h4-6,10H,7-9H2,1-3H3 |
| InChIKey |
HKUKTZQUYQPHQP-UHFFFAOYSA-N |
| Molecular Weight |
261.321 g/mol |
| SMILES |
C(N1C2=C(C=CC=C2CC=O)CC1)(OC(C)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924592 |
![[1-(Tert-butoxycarbonyl)indolin-7-yl]acetaldehyde](/api/spectrum/1qJnFrMlrd/structure.png?h=300&w=458 "[1-(Tert-butoxycarbonyl)indolin-7-yl]acetaldehyde")
