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(8S)-11,8-Diacetoxy-heptadeca-2(Z),9(Z)-diene-4,6-diyne
SpectraBase Compound ID Bvdhs7rm0xj
InChI InChI=1S/C21H28O4/c1-5-7-9-11-13-15-21(25-19(4)23)17-16-20(24-18(3)22)14-12-10-8-6-2/h5,7,16-17,20-21H,6,8,10,12,14H2,1-4H3/b7-5+,17-16-/t20?,21-/m1/s1
InChIKey YBCAWNJZOMHWRC-QKBZEBEWSA-N
Mol Weight 344.45 g/mol
Molecular Formula C21H28O4
Exact Mass 344.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6eGbR0qOXMT
Name (8S)-11,8-Diacetoxy-heptadeca-2(Z),9(Z)-diene-4,6-diyne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O4
InChI InChI=1S/C21H28O4/c1-5-7-9-11-13-15-21(25-19(4)23)17-16-20(24-18(3)22)14-12-10-8-6-2/h5,7,16-17,20-21H,6,8,10,12,14H2,1-4H3/b7-5+,17-16-/t20?,21-/m1/s1
InChIKey YBCAWNJZOMHWRC-QKBZEBEWSA-N
Molecular Weight 344.451 g/mol
SMILES C(C#C[C@](\C=C/C(OC(=O)C)CCCCCC)(OC(=O)C)[H])#C\C=C\C
SPLASH splash10-0a4i-0910000000-9a3053070d9a39ac5c7c
Source of Spectrum X2-57-1181-2
Wiley ID 1605593