SpectraBase Spectrum ID |
6D4orD3KZMo |
Name |
Pyrrolidine, 1-[[2-methyl-5-(1-methylethyl)cyclopentylidene]methyl]-, [2S-(1E,2.alpha.,5.alpha.)]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
207.198699809 u |
Formula |
C14H25N |
InChI |
InChI=1S/C14H25N/c1-11(2)13-7-6-12(3)14(13)10-15-8-4-5-9-15/h10-13H,4-9H2,1-3H3/b14-10+/t12-,13-/m1/s1 |
InChIKey |
JWMNTNWMQOOWTG-HUPKAIDTSA-N |
Molecular Weight |
207.361 g/mol |
SMILES |
C1N(\C=C\2[C@](CC[C@]2(C)[H])(C(C)C)[H])CCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944031 |