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(E)-3-(Heptadec-8'-enyl)-benzene-1,2diol
SpectraBase Compound ID 3WDHC7FQRhK
InChI InChI=1S/C23H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(24)23(21)25/h9-10,17,19-20,24-25H,2-8,11-16,18H2,1H3/b10-9+
InChIKey XOVWSFACOVXOLB-MDZDMXLPSA-N
Mol Weight 346.6 g/mol
Molecular Formula C23H38O2
Exact Mass 346.28718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9wqJyMmHhLK
Name 3-(Heptadec-8'-enyl)benzene-1,2-diol
CAS Registry Number 122850-19-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H38O2
InChI InChI=1S/C23H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(24)23(21)25/h9-10,17,19-20,24-25H,2-8,11-16,18H2,1H3/b10-9+
InChIKey XOVWSFACOVXOLB-MDZDMXLPSA-N
Molecular Weight 346.555 g/mol
SMILES Oc1c(c(ccc1)CCCCCCC\C=C\CCCCCCCC)O
SPLASH splash10-00di-0900000000-6b2a5730a2e851762b2d
Source of Spectrum KC-1989-437-4
Synonyms 3-[(8E)-8-heptadecenyl]-1,2-benzenediol
Wiley ID 1339737