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5'-Hexenyl 4-(Benzyloxycarbonylamino)benzoate
SpectraBase Compound ID IPpeZbobYJE
InChI InChI=1S/C21H23NO4/c1-2-3-4-8-15-25-20(23)18-11-13-19(14-12-18)22-21(24)26-16-17-9-6-5-7-10-17/h2,5-7,9-14H,1,3-4,8,15-16H2,(H,22,24)
InChIKey DVDNNWIANBQVAG-UHFFFAOYSA-N
Mol Weight 353.42 g/mol
Molecular Formula C21H23NO4
Exact Mass 353.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JsrpQV7ntsX
Name 5'-Hexenyl 4-(Benzyloxycarbonylamino)benzoate
Alternate Name(s) 5-Hexenyl 4-{[(benzyloxy)carbonyl]amino}benzoate
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Formula C21H23NO4
InChI InChI=1S/C21H23NO4/c1-2-3-4-8-15-25-20(23)18-11-13-19(14-12-18)22-21(24)26-16-17-9-6-5-7-10-17/h2,5-7,9-14H,1,3-4,8,15-16H2,(H,22,24)
InChIKey DVDNNWIANBQVAG-UHFFFAOYSA-N
Molecular Weight 353.418 g/mol
SMILES N(C(=O)OCc1ccccc1)c1ccc(C(=O)OCCCCC=C)cc1
SPLASH splash10-0007-9800000000-4197dff502141f635a28
Source of Spectrum KC-61-2227-14
Wiley ID 1627972