| SpectraBase Spectrum ID |
9XhsgUnwYru |
| Name |
7.alpha.,8-Cycloheptane[1,2-C]-1-methyl-8-(p-chlorophenyl)-.delta.(2)-pyrazoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
274.123676320 u |
| Formula |
C16H19ClN2 |
| InChI |
InChI=1S/C16H19ClN2/c1-19-16(12-6-8-13(17)9-7-12)10-11-4-2-3-5-14(18-19)15(11)16/h6-9,11,15H,2-5,10H2,1H3/t11-,15?,16?/m1/s1 |
| InChIKey |
ZSNGSUSHWXOUTJ-VHWKEVPUSA-N |
| Molecular Weight |
274.795 g/mol |
| SMILES |
C12(N(N=C3C2[C@@](C1)(CCCC3)[H])C)C=1C=CC(=CC1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.891779 |
![7.alpha.,8-Cycloheptane[1,2-C]-1-methyl-8-(p-chlorophenyl)-.delta.(2)-pyrazoline](/api/spectrum/9XhsgUnwYru/structure.png?h=300&w=458 "7.alpha.,8-Cycloheptane[1,2-C]-1-methyl-8-(p-chlorophenyl)-.delta.(2)-pyrazoline")
