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Lansiumarin-C [(E)-8-(6-hydroxy-3,7-dimethylocta-2,7-dienyloxy)psoralen]
SpectraBase Compound ID BLDe7NKf0mW
InChI InChI=1S/C21H22O5/c1-13(2)17(22)6-4-14(3)8-10-25-21-19-16(9-11-24-19)12-15-5-7-18(23)26-20(15)21/h5,7-9,11-12,17,22H,1,4,6,10H2,2-3H3/b14-8+
InChIKey DBHLROWQWPSCQG-RIYZIHGNSA-N
Mol Weight 354.4 g/mol
Molecular Formula C21H22O5
Exact Mass 354.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FkYBnTadHL
Name Lansiumarin-C [(E)-8-(6-hydroxy-3,7-dimethylocta-2,7-dienyloxy)psoralen]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O5
InChI InChI=1S/C21H22O5/c1-13(2)17(22)6-4-14(3)8-10-25-21-19-16(9-11-24-19)12-15-5-7-18(23)26-20(15)21/h5,7-9,11-12,17,22H,1,4,6,10H2,2-3H3/b14-8+
InChIKey DBHLROWQWPSCQG-RIYZIHGNSA-N
Molecular Weight 354.402 g/mol
SMILES OC(C(=C)C)CC\C(=C\COc1c2OC(=O)C=Cc2cc2ccoc12)C
SPLASH splash10-0uk9-0970000000-f8bd98a37f48fefde516
Source of Spectrum E1-46-342-6
Synonyms 9-[(2E)-6-hydroxy-3,7-dimethylocta-2,7-dienoxy]-7-furo[3,2-g][1]benzopyranone 9-[(2E)-6-hydroxy-3,7-dimethylocta-2,7-dienoxy]furo[3,2-g]chromen-7-one 9-[(2E)-3,7-dimethyl-6-oxidanyl-octa-2,7-dienoxy]furo[3,2-g]chromen-7-one
Wiley ID 1554166