SpectraBase Spectrum ID |
KyxQ5VFPsoW |
Name |
Ethyl (cis-6-methyltetrahydro-2-pyranyl)acetate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
186.125594437 u |
Formula |
C10H18O3 |
InChI |
InChI=1S/C10H18O3/c1-3-12-10(11)7-9-6-4-5-8(2)13-9/h8-9H,3-7H2,1-2H3/t8-,9-/m1/s1 |
InChIKey |
QLTNWIGJPPLTDQ-RKDXNWHRSA-N |
Molecular Weight |
186.251 g/mol |
SMILES |
C(C(=O)OCC)[C@@]1(O[C@](C)(CCC1)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.990272 |