SpectraBase Spectrum ID |
GlPktxqkAyh |
Name |
(1S,2R)-1'-Acetyl-2-phenylspiro[cyclopropane-1,3'-indolin]-2'-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
277.110278725 u |
Formula |
C18H15NO2 |
InChI |
InChI=1S/C18H15NO2/c1-12(20)19-16-10-6-5-9-14(16)18(17(19)21)11-15(18)13-7-3-2-4-8-13/h2-10,15H,11H2,1H3/t15-,18-/m1/s1 |
InChIKey |
QPCNZFKUZKMTHY-CRAIPNDOSA-N |
SMILES |
C1[C@@]([C@@]11C(N(C(=O)C)C2=CC=CC=C12)=O)(C1=CC=CC=C1)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951719 |