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1a-O-ethyl 2-O-methyl 3,7b-dihydro-1H-cyclopropa[c]isoquinoline-1a,2-dicarboxylate
SpectraBase Compound ID EIVJIC0FzXr
InChI InChI=1S/C15H17NO4/c1-3-20-13(17)15-8-12(15)11-7-5-4-6-10(11)9-16(15)14(18)19-2/h4-7,12H,3,8-9H2,1-2H3
InChIKey WWMGFZPRPBSTCQ-UHFFFAOYSA-N
Mol Weight 275.3 g/mol
Molecular Formula C15H17NO4
Exact Mass 275.115758 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FGPcbYcHMC
Name 1A-o-Ethyl 2-o-methyl 3,7B-dihydro-1H-cyclopropa[C]isoquinoline-1A,2-dicarboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 275.115758027 u
Formula C15H17NO4
InChI InChI=1S/C15H17NO4/c1-3-20-13(17)15-8-12(15)11-7-5-4-6-10(11)9-16(15)14(18)19-2/h4-7,12H,3,8-9H2,1-2H3
InChIKey WWMGFZPRPBSTCQ-UHFFFAOYSA-N
SMILES C12(N(C(=O)OC)CC3=C(C2C1)C=CC=C3)C(=O)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.827268