SpectraBase Spectrum ID |
K9U6adRbwS1 |
Name |
[(2S,3S)-1-Butyl-3-methyl-2-aziridinyl]methanol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
143.131014170 u |
Formula |
C8H17NO |
InChI |
InChI=1S/C8H17NO/c1-3-4-5-9-7(2)8(9)6-10/h7-8,10H,3-6H2,1-2H3/t7-,8+,9?/m0/s1 |
InChIKey |
NAHWPCSXZOAHIH-ZQTLJVIJSA-N |
Molecular Weight |
143.230 g/mol |
SMILES |
[C@]1(N([C@]1(C)[H])CCCC)(CO)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.952895 |