SpectraBase Compound ID | JYo4KlG4nTd |
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InChI | InChI=1S/C8H17N/c1-6-7(9(6)5)8(2,3)4/h6-7H,1-5H3 |
InChIKey | TWGPQRUYJQORNA-UHFFFAOYSA-N |
Mol Weight | 127.23 g/mol |
Molecular Formula | C8H17N |
Exact Mass | 127.1361 g/mol |
SpectraBase Spectrum ID | 3GUSt6lPBfw |
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Name | Aziridine, 2-tert-butyl-1,3-dimethyl-, trans- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 127.136099551 u |
Formula | C8H17N |
InChI | InChI=1S/C8H17N/c1-6-7(9(6)5)8(2,3)4/h6-7H,1-5H3 |
InChIKey | TWGPQRUYJQORNA-UHFFFAOYSA-N |
Molecular Weight | 127.231 g/mol |
SMILES | C(C)(C)(C)C1C(C)N1C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.967653 |