| SpectraBase Spectrum ID |
F0xGJiBeQIN |
| Name |
Nepetalactone<4a-alpha,7-beta,7a-alpha-> |
| CAS Registry Number |
21651-53-6 |
| 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 |
166.099379689 u |
| Formula |
C10H14O2 |
| 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/C10H14O2/c1-6-3-4-8-7(2)5-12-10(11)9(6)8/h5-6,8-9H,3-4H2,1-2H3/t6-,8-,9-/m0/s1 |
| InChIKey |
ZDKZHVNKFOXMND-XVYDVKMFSA-N |
| Molecular Weight |
166.220 g/mol |
| Nominal Mass |
166 u |
| Number of Peaks |
108 |
| SMILES |
C1([C@@]2([C@](C(=CO1)C)(CC[C@@]2(C)[H])[H])[H])=O |
| SPLASH |
splash10-0159-9200000000-d843c13641b9358bf927 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001007 |
