3-Methyl-3-[2-(2-methoxycarbonylphenyl)allyl]-2,3-dihydroindole-1,5-carboxylic acid dimethyl ester

SpectraBase Compound ID	2nPe3AdVRKv
InChI	InChI=1S/C24H25NO6/c1-15(17-8-6-7-9-18(17)22(27)30-4)13-24(2)14-25(23(28)31-5)20-11-10-16(12-19(20)24)21(26)29-3/h6-12H,1,13-14H2,2-5H3
InChIKey	ANPXFSMICBCXJM-UHFFFAOYSA-N Google Search
Mol Weight	423.47 g/mol
Molecular Formula	C24H25NO6
Exact Mass	423.168188 g/mol

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SpectraBase Spectrum ID	JW14PvY2ggD
Name	3-Methyl-3-[2-(2-methoxycarbonylphenyl)allyl]-2,3-dihydroindole-1,5-carboxylic acid dimethyl ester
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	423.168187523 u
Formula	C24H25NO6
InChI	InChI=1S/C24H25NO6/c1-15(17-8-6-7-9-18(17)22(27)30-4)13-24(2)14-25(23(28)31-5)20-11-10-16(12-19(20)24)21(26)29-3/h6-12H,1,13-14H2,2-5H3
InChIKey	ANPXFSMICBCXJM-UHFFFAOYSA-N
Molecular Weight	423.465 g/mol
SMILES	C1=2N(CC(C2C=C(C=C1)C(=O)OC)(CC(C1=C(C(=O)OC)C=CC=C1)=C)C)C(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR)	0.918705