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

*Links on SpectraBase are not permalinks.
3-Methyl-1-phenyl-6,7-dihydro-1H-oxepino[2,3-c]pyrazol-4(5H)-one
SpectraBase Compound ID 4YCyFoDpfe1
InChI InChI=1S/C14H14N2O2/c1-10-13-12(17)8-5-9-18-14(13)16(15-10)11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3
InChIKey MQNZPRLZGACVJL-UHFFFAOYSA-N
Mol Weight 242.28 g/mol
Molecular Formula C14H14N2O2
Exact Mass 242.105528 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 8bWHoCWund5
Name 3-Methyl-1-phenyl-6,7-dihydro-1H-oxepino[2,3-c]pyrazol-4(5H)-one
Appearance Off-white powder
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O2
InChI InChI=1S/C14H14N2O2/c1-10-13-12(17)8-5-9-18-14(13)16(15-10)11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3
InChIKey MQNZPRLZGACVJL-UHFFFAOYSA-N
Instrument Name Shimadzu QP 1000
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3015
Molecular Weight 242.278 g/mol
SMILES Cc1c2c([n](n1)-c1ccccc1)OCCCC2=O
SPLASH splash10-0006-5090000000-860e325dc41d5d83b95c
Source of Spectrum Y-55-135-4
Wiley ID 1878733