SpectraBase Spectrum ID |
8zq2eUw2UVR |
Name |
(1S)-1',2-Dimethyl-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 |
263.131014170 u |
Formula |
C18H17NO |
InChI |
InChI=1S/C18H17NO/c1-17(13-8-4-3-5-9-13)12-18(17)14-10-6-7-11-15(14)19(2)16(18)20/h3-11H,12H2,1-2H3/t17?,18-/m0/s1 |
InChIKey |
RICFPTCPKRONLT-ZVAWYAOSSA-N |
Molecular Weight |
263.340 g/mol |
SMILES |
C1[C@]2(C(N(C3=CC=CC=C23)C)=O)C1(C1=CC=CC=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92765 |