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Cyclopenteno[3,4-b]oxathiino[b][2.2]paracyclophane

View entire compound with spectra: 1 MS (GC)

Cyclopenteno[3,4-b]oxathiino[b][2.2]paracyclophane
SpectraBase Compound ID 2aGYgJ5P4lU
InChI InChI=1S/C21H20OS/c1-2-18-19(3-1)23-21-17-11-9-15-6-4-14(5-7-15)8-10-16(12-13-17)20(21)22-18/h1-2,4-7,12-13,18-19H,3,8-11H2/t18-,19+/m0/s1
InChIKey AERGKLYGAJYZHL-RBUKOAKNSA-N
Mol Weight 320.45 g/mol
Molecular Formula C21H20OS
Exact Mass 320.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LHPh2aA9v2i
Name Cyclopenteno[3,4-b]oxathiino[b][2.2]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20OS
InChI InChI=1S/C21H20OS/c1-2-18-19(3-1)23-21-17-11-9-15-6-4-14(5-7-15)8-10-16(12-13-17)20(21)22-18/h1-2,4-7,12-13,18-19H,3,8-11H2/t18-,19+/m0/s1
InChIKey AERGKLYGAJYZHL-RBUKOAKNSA-N
Molecular Weight 320.450 g/mol
SMILES c12S[C@]3([C@@](Oc2c2CCc4ccc(CCc1cc2)cc4)(C=CC3)[H])[H]
SPLASH splash10-01b9-2797000000-c51bec1b95947103cfb5
Source of Spectrum F-62-5629-10
Wiley ID 1633528