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2C-T-28 N,N-bis(cyclopropylmethyl)

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

2C-T-28 N,N-bis(cyclopropylmethyl)
SpectraBase Compound ID H7JWdPzikNe
InChI InChI=1S/C21H32FNO2S/c1-24-19-13-21(26-11-3-9-22)20(25-2)12-18(19)8-10-23(14-16-4-5-16)15-17-6-7-17/h12-13,16-17H,3-11,14-15H2,1-2H3
InChIKey BEBWTBZJWQJPDN-UHFFFAOYSA-N
Mol Weight 381.6 g/mol
Molecular Formula C21H32FNO2S
Exact Mass 381.213779 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7MyTlPCqLSz
Name 2C-T-28 N,N-bis(Cyclopropylmethyl)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 381.213778609 u
Formula C21H32FNO2S
InChI InChI=1S/C21H32FNO2S/c1-24-19-13-21(26-11-3-9-22)20(25-2)12-18(19)8-10-23(14-16-4-5-16)15-17-6-7-17/h12-13,16-17H,3-11,14-15H2,1-2H3
InChIKey BEBWTBZJWQJPDN-UHFFFAOYSA-N
Molecular Weight 381.550 g/mol
SMILES C1(=C(C=C(C(=C1)OC)SCCCF)OC)CCN(CC1CC1)CC1CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.812311