SpectraBase Spectrum ID |
K7wkMWYq1h5 |
Name |
Caryophylla-4(12),8(13)-dien5-.beta.-ol |
CAS Registry Number |
19431-80-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H24O |
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/C15H24O/c1-10-6-8-14(16)11(2)5-7-13-12(10)9-15(13,3)4/h12-14,16H,1-2,5-9H2,3-4H3/t12-,13-,14+/m1/s1 |
InChIKey |
CIIYOYPOMGIECX-MCIONIFRSA-N |
Molecular Weight |
220.356 g/mol |
SMILES |
O[C@@]1(C(CC[C@@]2([C@@](C(CC1)=C)(CC2(C)C)[H])[H])=C)[H] |
SPLASH |
splash10-0006-9500000000-e8faf1e429635aee3796 |
Source |
ex ACHILLEA ERIOPHORA ex PETER WEYERSTAHL |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
1886035 |