SpectraBase Spectrum ID |
7q54XVnVH5u |
Name |
cis-6-Methyl-1-[N-(2-methylpropyl)amino]-2-oxabicyclo[4.1.0]heptane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
183.162314299 u |
Formula |
C11H21NO |
InChI |
InChI=1S/C11H21NO/c1-9(2)7-12-11-8-10(11,3)5-4-6-13-11/h9,12H,4-8H2,1-3H3/t10-,11+/m0/s1 |
InChIKey |
XYMQQWAVICEJIY-WDEREUQCSA-N |
Molecular Weight |
183.295 g/mol |
SMILES |
[C@@]12([C@@](C)(CCCO2)C1)NCC(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956348 |