SpectraBase Spectrum ID |
EnLh112hPUK |
Name |
Succinic acid, di(2,4-dimethylpent-3-yl) ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
314.245709571 u |
Formula |
C18H34O4 |
InChI |
InChI=1S/C18H34O4/c1-11(2)17(12(3)4)21-15(19)9-10-16(20)22-18(13(5)6)14(7)8/h11-14,17-18H,9-10H2,1-8H3 |
InChIKey |
YJCKWPXGDRTLCZ-UHFFFAOYSA-N |
SMILES |
C(OC(C(C)C)C(C)C)(CCC(OC(C(C)C)C(C)C)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.83625 |