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

*Links on SpectraBase are not permalinks.
1H-Pyrazole-1-acetic acid, 3-[(1,3-benzodioxol-5-ylcarbonyl)amino]-, ethyl ester
SpectraBase Compound ID B4MHYDgnpYb
InChI InChI=1S/C15H15N3O5/c1-2-21-14(19)8-18-6-5-13(17-18)16-15(20)10-3-4-11-12(7-10)23-9-22-11/h3-7H,2,8-9H2,1H3,(H,16,17,20)
InChIKey KCPSTMNKSYWYPX-UHFFFAOYSA-N
Mol Weight 317.3 g/mol
Molecular Formula C15H15N3O5
Exact Mass 317.101171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID IkQEHdryw5V
Name 1H-Pyrazole-1-acetic acid, 3-[(1,3-benzodioxol-5-ylcarbonyl)amino]-, ethyl ester
Alternate Name(s) 2-[3-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-1-pyrazolyl]acetic acid ethyl ester Ethyl 2-[3-(1,3-benzodioxole-5-carbonylamino)pyrazol-1-yl]acetate Ethyl 2-[3-(1,3-benzodioxol-5-ylcarbonylamino)pyrazol-1-yl]ethanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15N3O5
InChI InChI=1S/C15H15N3O5/c1-2-21-14(19)8-18-6-5-13(17-18)16-15(20)10-3-4-11-12(7-10)23-9-22-11/h3-7H,2,8-9H2,1H3,(H,16,17,20)
InChIKey KCPSTMNKSYWYPX-UHFFFAOYSA-N
Molecular Weight 317.301 g/mol
SMILES N(C(=O)c1cc2c(cc1)OCO2)c1cc[n](n1)CC(OCC)=O
SPLASH splash10-0002-6911000000-f58e7aa13457a69c05a2
Source of Spectrum IY-2-4763-5
Wiley ID 1655618