| SpectraBase Spectrum ID |
8BxeakvdieN |
| Name |
2-Naphthalenecarboxamide, N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-1,4-dihydroxy-3-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
505.319208865 u |
| Formula |
C32H43NO4 |
| InChI |
InChI=1S/C32H43NO4/c1-8-31(4,5)22-16-17-26(25(20-22)32(6,7)9-2)37-19-13-12-18-33-30(36)27-21(3)28(34)23-14-10-11-15-24(23)29(27)35/h10-11,14-17,20,34-35H,8-9,12-13,18-19H2,1-7H3,(H,33,36) |
| InChIKey |
MFEXAQGVAATSGQ-UHFFFAOYSA-N |
| Molecular Weight |
505.699 g/mol |
| SMILES |
CCC(C)(C)C1=CC=C(OCCCCNC(=O)C2=C(C)C(O)=C3C=CC=CC3=C2O)C(=C1)C(C)(C)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940046 |
![2-Naphthalenecarboxamide, N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-1,4-dihydroxy-3-methyl-](/api/spectrum/8BxeakvdieN/structure.png?h=300&w=458 "2-Naphthalenecarboxamide, N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-1,4-dihydroxy-3-methyl-")
