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2-Amino-3-isopropylspiro[4.14]nonadeca-1,3-diene-1-carbonitrile
SpectraBase Compound ID 8Iv6CXY478w
InChI InChI=1S/C23H38N2/c1-19(2)20-17-23(21(18-24)22(20)25)15-13-11-9-7-5-3-4-6-8-10-12-14-16-23/h17,19H,3-16,25H2,1-2H3
InChIKey MTOLDSZIDDOGLA-UHFFFAOYSA-N
Mol Weight 342.6 g/mol
Molecular Formula C23H38N2
Exact Mass 342.303499 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9uAj0ILo1eA
Name 2-Amino-3-isopropylspiro[4.14]nonadeca-1,3-diene-1-carbonitrile
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 342.303499232 u
Formula C23H38N2
InChI InChI=1S/C23H38N2/c1-19(2)20-17-23(21(18-24)22(20)25)15-13-11-9-7-5-3-4-6-8-10-12-14-16-23/h17,19H,3-16,25H2,1-2H3
InChIKey MTOLDSZIDDOGLA-UHFFFAOYSA-N
Molecular Weight 342.571 g/mol
SMILES C1(=C(C(=CC11CCCCCCCCCCCCCC1)C(C)C)N)C#N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.861735