| SpectraBase Spectrum ID |
Eabe9BTt54m |
| Name |
4'-Cyclohexyl-1',2,5-tris[(E)-cyclohexylmethylene]-2',3',6',7'-tetrahydrospiro[cyclopentane-1,5'-(4''H)-indene] |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
540.469501932 u |
| Formula |
C40H60 |
| InChI |
InChI=1S/C40H60/c1-5-13-30(14-6-1)27-34-21-24-38-37(34)25-26-40(39(38)33-19-11-4-12-20-33)35(28-31-15-7-2-8-16-31)22-23-36(40)29-32-17-9-3-10-18-32/h27-33,39H,1-26H2/b34-27+,35-28+,36-29+ |
| InChIKey |
NCQWBJRFUQPRAQ-PJBKFWITSA-N |
| Molecular Weight |
540.920 g/mol |
| SMILES |
C12=C(\C(=C\C3CCCCC3)CC1)CCC1(C2C2CCCCC2)\C(=C\C2CCCCC2)CC\C1=C\C1CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960035 |
![4'-Cyclohexyl-1',2,5-tris[(E)-cyclohexylmethylene]-2',3',6',7'-tetrahydrospiro[cyclopentane-1,5'-(4''H)-indene]](/api/spectrum/Eabe9BTt54m/structure.png?h=300&w=458 "4'-Cyclohexyl-1',2,5-tris[(E)-cyclohexylmethylene]-2',3',6',7'-tetrahydrospiro[cyclopentane-1,5'-(4''H)-indene]")
