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2-(Chlolesta-3,5-dien-3-yl)benzo[b]furan

View entire compound with spectra: 1 MS (GC)

2-(Chlolesta-3,5-dien-3-yl)benzo[b]furan
SpectraBase Compound ID 9CW5tz6zIYM
InChI InChI=1S/C35H48O/c1-23(2)9-8-10-24(3)29-15-16-30-28-14-13-27-21-26(33-22-25-11-6-7-12-32(25)36-33)17-19-34(27,4)31(28)18-20-35(29,30)5/h6-7,11-13,21-24,28-31H,8-10,14-20H2,1-5H3/t24-,28?,29-,30?,31?,34+,35-/m1/s1
InChIKey KXHINENBTXMEFN-SWSNUGBSSA-N
Mol Weight 484.8 g/mol
Molecular Formula C35H48O
Exact Mass 484.370516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XRtPzueSjk
Name 2-(Chlolesta-3,5-dien-3-yl)benzo[b]furan
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H48O
InChI InChI=1S/C35H48O/c1-23(2)9-8-10-24(3)29-15-16-30-28-14-13-27-21-26(33-22-25-11-6-7-12-32(25)36-33)17-19-34(27,4)31(28)18-20-35(29,30)5/h6-7,11-13,21-24,28-31H,8-10,14-20H2,1-5H3/t24-,28?,29-,30?,31?,34+,35-/m1/s1
InChIKey KXHINENBTXMEFN-SWSNUGBSSA-N
Molecular Weight 484.768 g/mol
SMILES [C@@]12(C(C3CC=C4[C@@](C3CC2)(CCC(c2oc3ccccc3c2)=C4)C)CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])C
SPLASH splash10-001i-0300900000-e4b004ed13ed8d19dc6d
Source of Spectrum J-61-9286-7
Synonyms 3-(1-benzofuran-2-yl)cholesta-3,5-diene
Wiley ID 1396222