| SpectraBase Spectrum ID |
5ay9AcmYTEx |
| Name |
cis-1,2-di(Methoxycarbonyl)-4-(1-hydroxy-3-methyl-2-butenyl)-4-cyclohexene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
282.146723803 u |
| Formula |
C15H22O5 |
| InChI |
InChI=1S/C15H22O5/c1-9(2)7-13(16)10-5-6-11(14(17)19-3)12(8-10)15(18)20-4/h5,7,11-13,16H,6,8H2,1-4H3/t11-,12+,13?/m1/s1 |
| InChIKey |
GRVYTEZOXXTIOR-OJRHAOMCSA-N |
| SMILES |
[C@@]1([C@](C(=O)OC)(CC=C(C1)C(C=C(C)C)O)[H])(C(=O)OC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.855515 |
