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(1S,2R)-2-(Hexa-1'E,5'-dien-3'-ynyl)cyclopropane1-carbaldehyde

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

(1S,2R)-2-(Hexa-1'E,5'-dien-3'-ynyl)cyclopropane1-carbaldehyde
SpectraBase Compound ID 6XRB4Rpso6p
InChI InChI=1S/C10H10O/c1-2-3-4-5-6-9-7-10(9)8-11/h2,5-6,8-10H,1,7H2/b6-5+/t9-,10+/m0/s1
InChIKey ZMTIARSTVBEZHL-FQNVXPIYSA-N
Mol Weight 146.19 g/mol
Molecular Formula C10H10O
Exact Mass 146.073165 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8I3zfwaEzmk
Name (1S,2R)-2-(Hexa-1'E,5'-dien-3'-ynyl)CYCLOPROPANE1-carbaldehyde
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 146.073164941 u
Formula C10H10O
InChI InChI=1S/C10H10O/c1-2-3-4-5-6-9-7-10(9)8-11/h2,5-6,8-10H,1,7H2/b6-5+/t9-,10+/m0/s1
InChIKey ZMTIARSTVBEZHL-FQNVXPIYSA-N
Molecular Weight 146.189 g/mol
SMILES [C@@]1([C@@](C=O)(C1)[H])(\C=C\C#CC=C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.972857