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(3-13C)Corvol ether A
SpectraBase Compound ID Dj5Fv7hgJBr
InChI InChI=1S/C15H26O/c1-10(2)15-8-5-11(3)12-6-7-14(4,16-15)9-13(12)15/h10-13H,5-9H2,1-4H3/t11-,12+,13+,14-,15+/m1/s1/i14+1
InChIKey WNZXPDXXLQCXHX-QBQGLOJGSA-N
Mol Weight 223.36 g/mol
Molecular Formula C1413CH26O
Exact Mass 223.20172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BM0ox7H1Csm
Name (3-13C)Corvol ether A
Comments Original formula: C14[13C]H26O
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O
InChI InChI=1S/C15H26O/c1-10(2)15-8-5-11(3)12-6-7-14(4,16-15)9-13(12)15/h10-13H,5-9H2,1-4H3/t11-,12+,13+,14-,15+/m1/s1/i14+1
InChIKey WNZXPDXXLQCXHX-QBQGLOJGSA-N
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.12.132
Molecular Weight 223.364 g/mol
SMILES C1C[C@]([C@]2([C@]3([C@@]1(O[13C@](CC2)(C3)C)C(C)C)[H])[H])(C)[H]
SPLASH splash10-0bu0-4900000000-5722ed2f685c1cb3bbcf
Source of Spectrum BJO-12-SM4-(3-13C)-1
Wiley ID 1851701