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6,9-bis( Methylthio)-1,4-diphenyl-1,4,7,8-tetraazaspiro[4.4]nona-6,8-diene
SpectraBase Compound ID 12H6sjsQy0t
InChI InChI=1S/C19H20N4S2/c1-24-17-19(18(25-2)21-20-17)22(15-9-5-3-6-10-15)13-14-23(19)16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3
InChIKey UNRQLYGRPUATIC-UHFFFAOYSA-N
Mol Weight 368.52 g/mol
Molecular Formula C19H20N4S2
Exact Mass 368.112939 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KYKtUzorqjt
Name 6,9-bis( Methylthio)-1,4-diphenyl-1,4,7,8-tetraazaspiro[4.4]nona-6,8-diene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 368.112939008 u
Formula C19H20N4S2
InChI InChI=1S/C19H20N4S2/c1-24-17-19(18(25-2)21-20-17)22(15-9-5-3-6-10-15)13-14-23(19)16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3
InChIKey UNRQLYGRPUATIC-UHFFFAOYSA-N
Molecular Weight 368.517 g/mol
SMILES C12(C(=NN=C2SC)SC)N(CCN1C=1C=CC=CC1)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.846467