SpectraBase Spectrum ID |
5EhtjkIxvD0 |
Name |
Methyl levopimarate |
CAS Registry Number |
3513-69-7 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H32O2 |
GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
InChI |
InChI=1S/C21H32O2/c1-14(2)15-7-9-17-16(13-15)8-10-18-20(17,3)11-6-12-21(18,4)19(22)23-5/h7,13-14,17-18H,6,8-12H2,1-5H3 |
InChIKey |
SGPKKYHABMKBPF-UHFFFAOYSA-N |
Molecular Weight |
316.485 g/mol |
SMILES |
CC12C(C(C(OC)=O)(C)CCC2)CCC=2C1CC=C(C2)C(C)C |
SPLASH |
splash10-0006-4922000000-c5ca59d4eaab1e930abc |
Source |
PICEA ABIES, ME ESTERS OF DITERPENE ACIDS |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
1887648 |