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(18-O)-2,3-Epoxysqualene
SpectraBase Compound ID HuPycRXsjmS
InChI InChI=1S/C30H50O/c1-24(2)14-11-17-27(5)20-12-18-25(3)15-9-10-16-26(4)19-13-21-28(6)22-23-29-30(7,8)31-29/h14-16,20-21,29H,9-13,17-19,22-23H2,1-8H3/b25-15+,26-16+,27-20+,28-21+/i31+2
InChIKey QYIMSPSDBYKPPY-ZHXLSQEMSA-N
Mol Weight 428.7 g/mol
Molecular Formula C30H5018O
Exact Mass 428.390411 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLgxU7AGYRJ
Name (18-O)-2,3-Epoxysqualene
Comments Original formula: C30H50[18O]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O
InChI InChI=1S/C30H50O/c1-24(2)14-11-17-27(5)20-12-18-25(3)15-9-10-16-26(4)19-13-21-28(6)22-23-29-30(7,8)31-29/h14-16,20-21,29H,9-13,17-19,22-23H2,1-8H3/b25-15+,26-16+,27-20+,28-21+/i31+2
InChIKey QYIMSPSDBYKPPY-ZHXLSQEMSA-N
Molecular Weight 428.729 g/mol
SMILES C1([18O]C1CC\C(=C\CC\C(=C\CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)C)C)(C)C
SPLASH splash10-00lu-9100000000-4d934af73a2af089f42c
Source of Spectrum U-1993-1255-9
Wiley ID 765455