SpectraBase Spectrum ID |
5D67UqSYef0 |
Name |
Crocusatin-J |
Appearance |
Colorless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C10H16O3 |
InChI |
InChI=1S/C10H16O3/c1-6-4-8(12)9(13)10(2,3)7(6)5-11/h5,8-9,12-13H,4H2,1-3H3/t8-,9-/m1/s1 |
InChIKey |
YDOIHIWSLMXTHV-RKDXNWHRSA-N |
Instrument Name |
VG70-250S |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/np0302854 |
Molecular Weight |
184.235 g/mol |
Optical Rotation |
[a]D25 = +68 (c = 0.02, MeOH) |
Reported Formula |
C10H16O3 |
SMILES |
O[C@]1(C(C(=C(C[C@]1(O)[H])C)C=O)(C)C)[H] |
SPLASH |
splash10-0f6x-0900000000-c5b5b2f024bf0c4a54f5 |
Source of Spectrum |
G4-67-440-1 |
Wiley ID |
1881674 |