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Strongylophorine-22
SpectraBase Compound ID AVTXj0VSbFO
InChI InChI=1S/C26H38O2/c1-23(2)11-6-12-24(3)20(23)9-13-25(4)21(24)10-14-26(5)22(25)16-17-15-18(27)7-8-19(17)28-26/h7-8,15,20-22,27H,6,9-14,16H2,1-5H3/t20-,21+,22-,24-,25+,26-/m0/s1
InChIKey RFNMUDSLOPJKMY-TXIQQBFSSA-N
Mol Weight 382.6 g/mol
Molecular Formula C26H38O2
Exact Mass 382.28718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4dwLu3Uwzn
Name Strongylophorine-22
Appearance Colorless needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.287180462 u
Formula C26H38O2
InChI InChI=1S/C26H38O2/c1-23(2)11-6-12-24(3)20(23)9-13-25(4)21(24)10-14-26(5)22(25)16-17-15-18(27)7-8-19(17)28-26/h7-8,15,20-22,27H,6,9-14,16H2,1-5H3/t20-,21+,22-,24-,25+,26-/m0/s1
InChIKey RFNMUDSLOPJKMY-TXIQQBFSSA-N
Instrument Name Thermo Quest TSQ 700
Ionization Type EI
Literature Reference DOI 10.1021/np030312q
Molecular Weight 382.588 g/mol
Optical Rotation [a]D25 = -75.2 (c = 1.1, CHCl3)
Quality 59
Reported Formula C26H38O2
SMILES OC=1C=CC=2O[C@]3(CC[C@@]4([C@]5(CCCC([C@@]5(CC[C@]4([C@@]3(CC2C1)[H])C)[H])(C)C)C)[H])C
SPLASH splash10-001i-0129000000-e1af52175d92a46c0f14
Source of Spectrum G4-66-1602-1 (DOI: 10.1021/np030312q)
Wiley ID 1892580