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2-methoxy-4-{N-[3,4-(methylenedioxy)phenyl]formimidoyl]phenol, benzoate
SpectraBase Compound ID 4NHi0iTyrDF
InChI InChI=1S/C22H17NO5/c1-25-20-11-15(13-23-17-8-10-18-21(12-17)27-14-26-18)7-9-19(20)28-22(24)16-5-3-2-4-6-16/h2-13H,14H2,1H3/b23-13+
InChIKey NLBCSXHLFVPZAE-YDZHTSKRSA-N
Mol Weight 375.38 g/mol
Molecular Formula C22H17NO5
Exact Mass 375.110673 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AAkSyMAiVNY
Name 2-METHOXY-4-{N-[3,4-(METHYLENEDIOXY)PHENYL]FORMIMIDOYL}PHENOL, BENZOATE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17NO5
InChI InChI=1S/C22H17NO5/c1-25-20-11-15(13-23-17-8-10-18-21(12-17)27-14-26-18)7-9-19(20)28-22(24)16-5-3-2-4-6-16/h2-13H,14H2,1H3/b23-13+
InChIKey NLBCSXHLFVPZAE-YDZHTSKRSA-N
Melting Point 90.5-93C
Molecular Weight 375.38
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms PHENOL, 2-METHOXY- 4-/N-/3,4-/METHYLENEDIOXY/PHENYL/FORMIMIDOYL/-, BENZOATE P-CRESOL, 2-METHOXY-A-//3,4-/METHYLENEDIOXY/PHENYL/IMINO/-, BENZOATE