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

*Links on SpectraBase are not permalinks.

Tricyclo[3.2.1.0(2,4)]octane, 1-methyl-

View entire compound with spectra: 1 FTIR

Tricyclo[3.2.1.0(2,4)]octane, 1-methyl-
SpectraBase Compound ID 5dHU346P85E
InChI InChI=1S/C9H14/c1-9-3-2-6(5-9)7-4-8(7)9/h6-8H,2-5H2,1H3/t6-,7+,8+,9+/m0/s1
InChIKey SMJROXSMWHJZJX-JQCXWYLXSA-N
Mol Weight 122.21 g/mol
Molecular Formula C9H14
Exact Mass 122.10955 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 4mJgmMuFOwX
Name Tricyclo[3.2.1.0(2,4)]octane, 1-methyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 122.109550451 u
Formula C9H14
InChI InChI=1S/C9H14/c1-9-3-2-6(5-9)7-4-8(7)9/h6-8H,2-5H2,1H3/t6-,7+,8+,9+/m0/s1
InChIKey SMJROXSMWHJZJX-JQCXWYLXSA-N
Molecular Weight 122.211 g/mol
SMILES [C@@]12(C[C@@](C)(CC2)[C@]2([C@@]1(C2)[H])[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.846731