For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-[8-(4-Chlorophenyl)-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazin-6-yl]benzoic acid

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-[8-(4-Chlorophenyl)-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazin-6-yl]benzoic acid
SpectraBase Compound ID 36ysZzCLleL
InChI InChI=1S/C20H16ClNO3/c21-14-7-5-13(6-8-14)17-11-18(22-9-10-25-12-19(17)22)15-3-1-2-4-16(15)20(23)24/h1-8,11H,9-10,12H2,(H,23,24)
InChIKey PZGCESIRLAUGTD-UHFFFAOYSA-N
Mol Weight 353.81 g/mol
Molecular Formula C20H16ClNO3
Exact Mass 353.081871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AcETgAHH1YB
Name 2-[8-(4-Chlorophenyl)-3,4-dihydro-1H-pyrrolo[2,1-C][1,4]oxazin-6-yl]benzoic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.081871076 u
Formula C20H16ClNO3
InChI InChI=1S/C20H16ClNO3/c21-14-7-5-13(6-8-14)17-11-18(22-9-10-25-12-19(17)22)15-3-1-2-4-16(15)20(23)24/h1-8,11H,9-10,12H2,(H,23,24)
InChIKey PZGCESIRLAUGTD-UHFFFAOYSA-N
Molecular Weight 353.805 g/mol
SMILES C(C=1C(=CC=CC1)C=1N2C(COCC2)=C(C1)C=1C=CC(=CC1)Cl)(=O)O