SpectraBase Spectrum ID |
1zHCIRtGND7 |
Name |
Aziridine, 2-methyl-2-(1-methylethyl)-3-phenyl-, cis- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
175.136099551 u |
Formula |
C12H17N |
InChI |
InChI=1S/C12H17N/c1-9(2)12(3)11(13-12)10-7-5-4-6-8-10/h4-9,11,13H,1-3H3 |
InChIKey |
HPMFXAKGFRIUSS-UHFFFAOYSA-N |
Molecular Weight |
175.275 g/mol |
SMILES |
C1(NC1C=1C=CC=CC1)(C(C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.927699 |