SpectraBase Spectrum ID |
Anr5KfgCRLJ |
Name |
Benzene, 1-chloro-4-[(1-methylethylidene)cyclopropyl]-, (R)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
192.070578119 u |
Formula |
C12H13Cl |
InChI |
InChI=1S/C12H13Cl/c1-8(2)11-7-12(11)9-3-5-10(13)6-4-9/h3-6,12H,7H2,1-2H3/t12-/m1/s1 |
InChIKey |
MFGQJVQMTGWSEV-GFCCVEGCSA-N |
Molecular Weight |
192.689 g/mol |
SMILES |
C(C)(C)=C1[C@@](C2=CC=C(C=C2)Cl)(C1)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913236 |