SpectraBase Spectrum ID |
CAO25V0ZxOC |
Name |
.beta.-Thujaplicinol |
Alternate Name(s) |
Thujaplicinol<.beta.-> |
CAS Registry Number |
4356-35-8 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C10H12O3 |
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/C10H12O3/c1-6(2)7-3-4-8(11)10(13)9(12)5-7/h3-6H,1-2H3,(H2,11,12,13) |
InChIKey |
HVGNSPLLPQWYGC-UHFFFAOYSA-N |
Molecular Weight |
180.203 g/mol |
SMILES |
OC1=CC=C(C=C(C1=O)O)C(C)C |
SPLASH |
splash10-0019-7900000000-b0fc8f223b65d0565a31 |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
1887080 |