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1-(1H-1,2,4-Triazol-5-yl)-1-octadecanol

View entire compound with spectra: 3 MS (GC)

1-(1H-1,2,4-Triazol-5-yl)-1-octadecanol
SpectraBase Compound ID l9JGcaUttT
InChI InChI=1S/C20H39N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(24)20-21-18-22-23-20/h18-19,24H,2-17H2,1H3,(H,21,22,23)
InChIKey QYPMHBDRCMWGBC-UHFFFAOYSA-N
Mol Weight 337.6 g/mol
Molecular Formula C20H39N3O
Exact Mass 337.309313 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9OFQDWgoj1t
Name 1-(1H-1,2,4-Triazol-5-yl)-1-octadecanol
CAS Registry Number 74897-77-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H39N3O
InChI InChI=1S/C20H39N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(24)20-21-18-22-23-20/h18-19,24H,2-17H2,1H3,(H,21,22,23)
InChIKey QYPMHBDRCMWGBC-UHFFFAOYSA-N
Molecular Weight 337.552 g/mol
SMILES [nH]1ncnc1C(CCCCCCCCCCCCCCCCC)O
SPLASH splash10-0005-9422000000-6dfe31389ef288f8e41a
Source of Spectrum H-63-598-15
Synonyms 1-(1H-1,2,4-triazol-5-yl)octadecan-1-ol 1H-1,2,4-Triazole, 5-(1-hydroxyoctadecyl)-
Wiley ID 1333205