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Quinazoline, 3,4-dihydro-2-allylthio-4-spirocyclohexane-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Quinazoline, 3,4-dihydro-2-allylthio-4-spirocyclohexane-
SpectraBase Compound ID 8Va0UOM1WFp
InChI InChI=1S/C16H24N2S/c1-2-12-19-15-17-14-9-5-4-8-13(14)16(18-15)10-6-3-7-11-16/h2H,1,3-12H2,(H,17,18)
InChIKey IEPPLGOKQSCQND-UHFFFAOYSA-N
Mol Weight 276.44 g/mol
Molecular Formula C16H24N2S
Exact Mass 276.16602 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1HbNozIh4k1
Name Quinazoline, 3,4-dihydro-2-allylthio-4-spirocyclohexane-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 276.166019955 u
Formula C16H24N2S
InChI InChI=1S/C16H24N2S/c1-2-12-19-15-17-14-9-5-4-8-13(14)16(18-15)10-6-3-7-11-16/h2H,1,3-12H2,(H,17,18)
InChIKey IEPPLGOKQSCQND-UHFFFAOYSA-N
Molecular Weight 276.442 g/mol
SMILES C1CCC2(CC1)NC(=NC1=C2CCCC1)SCC=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.91666