| SpectraBase Spectrum ID |
FAbSNoOoPSP |
| Name |
(1S,2S)-2-Methyl-1-[(2R)-2-methyl-2-oxiranyl]-3-buten-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
142.099379689 u |
| Formula |
C8H14O2 |
| InChI |
InChI=1S/C8H14O2/c1-4-6(2)7(9)8(3)5-10-8/h4,6-7,9H,1,5H2,2-3H3/t6-,7-,8+/m0/s1 |
| InChIKey |
MFBNDRWSSVJXSM-BIIVOSGPSA-N |
| Molecular Weight |
142.198 g/mol |
| SMILES |
[C@@]1(OC1)([C@]([C@](C=C)(C)[H])(O)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940522 |
![(1S,2S)-2-methyl-1-[(2R)-2-methyl-2-oxiranyl]-3-buten-1-ol](/api/spectrum/FAbSNoOoPSP/structure.png?h=300&w=458 "(1S,2S)-2-methyl-1-[(2R)-2-methyl-2-oxiranyl]-3-buten-1-ol")
