SpectraBase Spectrum ID |
JFAivpnUPum |
Name |
6H-Dibenzo[B,D]pyran, 6A,7,10,10A-tetrahydro-6,6,9-trimethyl-3-pentyl-1-[(tetrahydro-2H-pyran-2-yl)oxy]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
398.282095081 u |
Formula |
C26H38O3 |
InChI |
InChI=1S/C26H38O3/c1-5-6-7-10-19-16-22(28-24-11-8-9-14-27-24)25-20-15-18(2)12-13-21(20)26(3,4)29-23(25)17-19/h12,16-17,20-21,24H,5-11,13-15H2,1-4H3 |
InChIKey |
ZZBNQTNMVMVUDA-UHFFFAOYSA-N |
Molecular Weight |
398.587 g/mol |
SMILES |
C1(OC2CCCCO2)=C2C3C(C(OC2=CC(=C1)CCCCC)(C)C)CC=C(C3)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.841225 |