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(1S,2S)-(+)-trans-1,2-bis(methylamino)cyclohexane
SpectraBase Compound ID HJDHQR393QT
InChI InChI=1S/C8H18N2/c1-9-7-5-3-4-6-8(7)10-2/h7-10H,3-6H2,1-2H3/t7-,8-/m0/s1
InChIKey JRHPOFJADXHYBR-YUMQZZPRSA-N
Mol Weight 142.25 g/mol
Molecular Formula C8H18N2
Exact Mass 142.146999 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID LeE4ysvCbwd
Name (1S,2S)-(+)-trans-1,2-bis(methylamino)cyclohexane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 142.146998588 u
Formula C8H18N2
InChI InChI=1S/C8H18N2/c1-9-7-5-3-4-6-8(7)10-2/h7-10H,3-6H2,1-2H3/t7-,8-/m0/s1
InChIKey JRHPOFJADXHYBR-YUMQZZPRSA-N
Molecular Weight 142.246 g/mol
SMILES N([C@@]1([C@](CCCC1)(NC)[H])[H])C
Spectrum/Structure Validation Score (Raman) 0.965068