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E-CITRAL

View entire compound with spectra: 22 NMR, 9 FTIR, and 52 MS (GC)

E-CITRAL
SpectraBase Compound ID JhpjZgVeJEI
InChI InChI=1S/C10H16O/c1-9(2)5-4-6-10(3)7-8-11/h5,7-8H,4,6H2,1-3H3/b10-7+
InChIKey WTEVQBCEXWBHNA-JXMROGBWSA-N
Mol Weight 152.24 g/mol
Molecular Formula C10H16O
Exact Mass 152.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EUW0LeDX3C
Name (2E)-3,7-Dimethyl-2,6-octadienal
CAS Registry Number 5392-40-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O
InChI InChI=1S/C10H16O/c1-9(2)5-4-6-10(3)7-8-11/h5,7-8H,4,6H2,1-3H3/b10-7+
InChIKey WTEVQBCEXWBHNA-JXMROGBWSA-N
Molecular Weight 152.237 g/mol
SMILES C(CC\C(C)=C\C=O)=C(C)C
SPLASH splash10-0006-9100000000-f79ee5620c7f0d814ae1
Source of Spectrum JZ-1992-1299-0
Synonyms (2E)-3,7-dimethylocta-2,6-dienal (E)-3,7-Dimethyl-2,6-octadienal 2,6-Octadienal, 3,7-dimethyl-, (E)- (E)-3,7-Dimethylocta-2,6-dienal (E)-Citral (E)-Geranial (E)-Neral 2,6-Octadienal, 3,7-dimethyl- (Z)-3,7-Dimethyl-2,6-octadienal .alpha.-Citral .beta.-Citral .beta.-Geranial 2,6-Dimethyloctadien-2,6-al-8 2,6-Octadienal, 3,7-dimethyl-, (2E)- 3,7-Dimethyl-2,6-octadienal 2,6-Octadienal, 3,7-dimethyl-, (Z)- 3,7-Dimethyl-1,2,6-octadienal 3,7-Dimethyl-trans-2,6-octadienal cis,trans-Citral cis-3,7-Dimethyl-2,6-octadienal cis-Citral cis/trans-3,7-dimethyl-2,6-octadienal Citral Citral .alpha. Citral alpha Citral b Genanial Geranaldehyde Geranial Lemarome n Lemsyn GB NERAL trans-3,7-Dimethyl-2,6-octadienal trans-Citral Z-Citral AI3-01011 AI3-28519 BRN 1721871 BRN 1721873 CASWELL NO. 221B CCRIS 1043 EINECS 205-476-5 EINECS 226-394-6 EPA PESTICIDE CHEMICAL CODE 040510 FEMA NO. 2303 HSDB 993 NCI-C56348 NSC 6170
Wiley ID 1149283