| SpectraBase Spectrum ID |
4VHbzWI3UW |
| Name |
Dihydro agarofuran |
| CAS Registry Number |
5956-09-2 |
| 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 |
238.229665585 u |
| Formula |
C16H30O |
| 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/C16H30O/c1-12-9-11-15(5)10-7-8-13(2)16(15,6)17-14(12,3)4/h12-13H,7-11H2,1-6H3/t12-,13+,15-,16-/m1/s1 |
| InChIKey |
COCGPTWLAZDGMU-OCVGTWLNSA-N |
| Molecular Weight |
238.415 g/mol |
| Nominal Mass |
238 u |
| Number of Peaks |
126 |
| SMILES |
C[C@@]12[C@](CCC[C@@]1(CC[C@](C(C)(C)O2)(C)[H])C)(C)[H] |
| SPLASH |
splash10-0a4u-9830000000-fc8c1baa906c514f949e |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000476 |
