SpectraBase Spectrum ID |
9wLfbJkbF7h |
Name |
2-[2'-(Hept-1''-enyl)cyclopropyl]-4,5-bis[diphenyl(methoxy)methyl]-1,3,2-dioxaborolane |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
600.341090095 u |
Formula |
C40H45BO4 |
InChI |
InChI=1S/C40H45BO4/c1-4-5-6-7-12-21-31-30-36(31)41-44-37(39(42-2,32-22-13-8-14-23-32)33-24-15-9-16-25-33)38(45-41)40(43-3,34-26-17-10-18-27-34)35-28-19-11-20-29-35/h8-29,31,36-38H,4-7,30H2,1-3H3/b21-12+ |
InChIKey |
ZWMRDDIQFJFYJG-CIAFOILYSA-N |
Molecular Weight |
600.606 g/mol |
SMILES |
C1(OB(OC1C(C=1C=CC=CC1)(C=1C=CC=CC1)OC)C1CC1\C=C\CCCCC)C(C1=CC=CC=C1)(C1=CC=CC=C1)OC |