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Benzylamine, N-(3-chloro-2,2-dimethyl-1-propylidene)-

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

Benzylamine, N-(3-chloro-2,2-dimethyl-1-propylidene)-
SpectraBase Compound ID KE7MNoIi632
InChI InChI=1S/C12H16ClN/c1-12(2,9-13)10-14-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3/b14-10+
InChIKey PQLXHKQHGBOODJ-GXDHUFHOSA-N
Mol Weight 209.72 g/mol
Molecular Formula C12H16ClN
Exact Mass 209.097127 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6k10UoozDHB
Name Benzylamine, N-(3-chloro-2,2-dimethyl-1-propylidene)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 209.097127219 u
Formula C12H16ClN
InChI InChI=1S/C12H16ClN/c1-12(2,9-13)10-14-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3/b14-10+
InChIKey PQLXHKQHGBOODJ-GXDHUFHOSA-N
Molecular Weight 209.720 g/mol
SMILES C1=C(C=CC=C1)C\N=C\C(CCl)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.92785