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2,7-Dimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]-1-benzopyran-6-ol
SpectraBase Compound ID rPVRNgdPZo
InChI InChI=1S/C27H38O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)23(5)18-26(24)29-27/h10,12,14-15,17-19,28H,7-9,11,13,16H2,1-6H3/b21-12+,22-14+
InChIKey CXPRFJNZKVPOQN-QRCIITMISA-N
Mol Weight 394.6 g/mol
Molecular Formula C27H38O2
Exact Mass 394.28718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zfsgvs6OJO
Name 2,7-Dimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]-1-benzopyran-6-ol
Alternate Name(s) 2,7-Dimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]chromen-6-ol
CAS Registry Number 80994-02-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H38O2
InChI InChI=1S/C27H38O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)23(5)18-26(24)29-27/h10,12,14-15,17-19,28H,7-9,11,13,16H2,1-6H3/b21-12+,22-14+
InChIKey CXPRFJNZKVPOQN-QRCIITMISA-N
Molecular Weight 394.599 g/mol
SMILES Oc1c(cc2OC(CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)(C)C=Cc2c1)C
SPLASH splash10-004i-1901000000-9ae929d6e5793c2013aa
Source of Spectrum B-34-2680-0
Wiley ID 1366882