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YM-1-28.1

View entire compound with spectra: 1 MS (GC)

YM-1-28.1
SpectraBase Compound ID KDSpCNzNiAX
InChI InChI=1S/C16H22O5/c1-9-5-6-11-10(2)15(17)19-13(11)14-16(3,20-14)8-7-12(9)21-18-4/h11-14H,1-2,5-8H2,3-4H3
InChIKey CNCKUPZCPUOBBV-UHFFFAOYSA-N
Mol Weight 294.35 g/mol
Molecular Formula C16H22O5
Exact Mass 294.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GkYS7Mmuqq2
Name YM-1-28.1
CAS Registry Number 71277-24-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O5
InChI InChI=1S/C16H22O5/c1-9-5-6-11-10(2)15(17)19-13(11)14-16(3,20-14)8-7-12(9)21-18-4/h11-14H,1-2,5-8H2,3-4H3
InChIKey CNCKUPZCPUOBBV-UHFFFAOYSA-N
Molecular Weight 294.347 g/mol
SMILES CC12C(C3C(C(=C)C(O3)=O)CCC(C(CC1)OOC)=C)O2
SPLASH splash10-01ot-0090000000-94af332f378bed86a984
Source of Spectrum J-44-3955-0
Wiley ID 1297124