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(1S,2R)-1'-acetyl-2-phenylspiro[cyclopropane-1,3'-indolin]-2'-one
SpectraBase Compound ID 2BLrO4WizHd
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
Mol Weight 277.32 g/mol
Molecular Formula C18H15NO2
Exact Mass 277.110279 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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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