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N-(-)-thujylidenephenylethylamine
SpectraBase Compound ID IVZyiOfsDA7
InChI InChI=1S/C18H25N/c1-13(2)18-11-16(18)14(3)17(12-18)19-10-9-15-7-5-4-6-8-15/h4-8,13-14,16H,9-12H2,1-3H3/b19-17-
InChIKey WIHSKQWQJMDSLQ-ZPHPHTNESA-N
Mol Weight 255.4 g/mol
Molecular Formula C18H25N
Exact Mass 255.1987 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BmKO26WVd7M
Name N-(-)-thujylidenephenylethylamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 255.198699809 u
Formula C18H25N
InChI InChI=1S/C18H25N/c1-13(2)18-11-16(18)14(3)17(12-18)19-10-9-15-7-5-4-6-8-15/h4-8,13-14,16H,9-12H2,1-3H3/b19-17-
InChIKey WIHSKQWQJMDSLQ-ZPHPHTNESA-N
Molecular Weight 255.405 g/mol
SMILES C1=CC(=CC=C1)CC\N=C\1CC2(CC2C1C)C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.894506