SpectraBase Spectrum ID |
KQd9stHsPXH |
Name |
(+)-(R)-1-ethyl-2-methylene-1,2,3,4-tetrahydronaphthalene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
172.125200515 u |
Formula |
C13H16 |
InChI |
InChI=1S/C13H16/c1-3-12-10(2)8-9-11-6-4-5-7-13(11)12/h4-7,12H,2-3,8-9H2,1H3/t12-/m1/s1 |
InChIKey |
MAQLPRFZXQCWRW-GFCCVEGCSA-N |
Molecular Weight |
172.271 g/mol |
SMILES |
C1=CC=C2CCC([C@](C2=C1)(CC)[H])=C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.845923 |