SpectraBase Spectrum ID |
GcEDwaILaHE |
Name |
Methyl hexahydro-1'-oxospiro[cyclopropane]-1,5'(1' H)-pentaleno[1,2-C]furan-3'B(4' H)-carboxylate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
250.120509056 u |
Formula |
C14H18O4 |
InChI |
InChI=1S/C14H18O4/c1-17-12(16)14-7-13(2-3-13)5-8(14)4-9-10(14)6-18-11(9)15/h8-10H,2-7H2,1H3/t8-,9+,10+,14-/m1/s1 |
InChIKey |
DOYDWRJLLKLXST-MAGOMRGPSA-N |
Molecular Weight |
250.294 g/mol |
SMILES |
[C@]12([C@@]3([C@@](C(=O)OC3)(C[C@@]1(CC1(C2)CC1)[H])[H])[H])C(=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939239 |