SpectraBase Spectrum ID |
8vDDqwFxmuu |
Name |
3-[(1S,4S)-6-methoxy-4,7-dimethyl-tetralin-1-yl]but-3-en-1-ol |
Carrier Gas |
Hydrogen |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
260.177630011 u |
Formula |
C17H24O2 |
GC Oven Program |
Oven temp 300 oC |
InChI |
InChI=1S/C17H24O2/c1-11-5-6-14(12(2)7-8-18)16-9-13(3)17(19-4)10-15(11)16/h9-11,14,18H,2,5-8H2,1,3-4H3/t11-,14-/m0/s1 |
InChIKey |
HPPWFTIVFZBAHT-FZMZJTMJSA-N |
Instrument Name |
Agilent GC6890-HP 5973 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/ejoc.202200058 |
Molecular Weight |
260.377 g/mol |
Optical Rotation |
[a]D20 = 271.3 (365 nm), 162.3 (436 nm), 89.8 (546 nm), 77.8 (579 nm), 74.1 (589 nm) (1.0 g/100 ml in CHCl3) |
Quality |
476 |
SMILES |
OCCC([C@@]1(CC[C@@](C2=C1C=C(C(=C2)OC)C)(C)[H])[H])=C |
SPLASH |
splash10-002r-0950000000-0cd43269e35bfab94e90 |
Source of Spectrum |
K1-2022-SM29-29-1 (DOI: 10.1002/ejoc.202200058) |
Thin-Layer Chromatography |
0.4 (SiO2, cHex/MTBE, 2:1) |
Wiley ID |
1898693 |