SpectraBase Spectrum ID |
Knjia4uWdys |
Name |
Spiro[decahydroquinoline-4,2'-oxirane], 1,2-dimethyl-3-hydroxymethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
225.172878983 u |
Formula |
C13H23NO2 |
InChI |
InChI=1S/C13H23NO2/c1-9-7-13(12(8-15)16-13)10-5-3-4-6-11(10)14(9)2/h9-12,15H,3-8H2,1-2H3 |
InChIKey |
UPPIYFZGRWJZFF-UHFFFAOYSA-N |
Molecular Weight |
225.332 g/mol |
SMILES |
CC1N(C)C2C(C3(C1)C(CO)O3)CCCC2 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896832 |