| SpectraBase Spectrum ID |
CxWzyIsogg7 |
| Name |
Totarene |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
272.250401030 u |
| Formula |
C20H32 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C20H32/c1-14-13-18(5)10-11-19-15(2)7-6-8-17(19,4)9-12-20(18,19)16(14)3/h15-16H,1,6-13H2,2-5H3/t15-,16-,17+,18-,19+,20+/m1/s1 |
| InChIKey |
FCMUPMSHXJZJBX-NADOGSGZSA-N |
| Molecular Weight |
272.476 g/mol |
| Nominal Mass |
272 u |
| Number of Peaks |
164 |
| SMILES |
[C@]12([C@]3([C@@](C(C2)=C)(C)[H])[C@]2(CC1)[C@](CC3)(CCC[C@]2(C)[H])C)C |
| SPLASH |
splash10-059x-7910000000-92d30f682070ab7848bc |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001341 |
![(3R,3AS,5AS,9R,9AS,11AR)-3,5A,9,11A-TETRAMETHYL-2-METHYLENEDODECAHYDRO-4H-PENTALENO-[6A,1-C]-INDENE;WAIHOENSENE](/api/spectrum/CxWzyIsogg7/structure.png?h=300&w=458 "(3R,3AS,5AS,9R,9AS,11AR)-3,5A,9,11A-TETRAMETHYL-2-METHYLENEDODECAHYDRO-4H-PENTALENO-[6A,1-C]-INDENE;WAIHOENSENE")
