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[3-(Aminomethyl)adamantan-1-yl]methanamine

View entire compound with spectra: 1 FTIR

[3-(Aminomethyl)adamantan-1-yl]methanamine
SpectraBase Compound ID AVxABwa5X6S
InChI InChI=1S/C12H22N2/c13-7-11-2-9-1-10(4-11)5-12(3-9,6-11)8-14/h9-10H,1-8,13-14H2/t9-,10+,11+,12-
InChIKey RXEAFMOPSFWZFL-IWDIQUIJSA-N
Mol Weight 194.32 g/mol
Molecular Formula C12H22N2
Exact Mass 194.178299 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KEjLbJdZswh
Name [3-(Aminomethyl)adamantan-1-yl]methanamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 194.178298716 u
Formula C12H22N2
InChI InChI=1S/C12H22N2/c13-7-11-2-9-1-10(4-11)5-12(3-9,6-11)8-14/h9-10H,1-8,13-14H2/t9-,10+,11+,12-
InChIKey RXEAFMOPSFWZFL-IWDIQUIJSA-N
Molecular Weight 194.322 g/mol
SMILES C1[C@]2(C[C@]3(C[C@@]1(C[C@](C2)(CN)C3)[H])[H])CN
Spectrum/Structure Validation Score (Vapor Phase IR) 0.93243