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RL-C;CAROTA-1,4-DIENALDEHYDE
SpectraBase Compound ID EEbRSCjUKyq
InChI InChI=1S/C15H22O/c1-11(2)13-7-9-15(3)8-6-12(10-16)4-5-14(13)15/h5-6,10-11,13H,4,7-9H2,1-3H3/t13-,15+/m1/s1
InChIKey SZOHSTQGGUHULY-HIFRSBDPSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1iieduEiT9B
Name carota-1,4-dienaldehyde
Alternate Name(s) (1R,3aR)-1-isopropyl-3a-methyl-1,2,3,3a,4,7-hexahydro-6-azulenecarbaldehyde
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Formula C15H22O
InChI InChI=1S/C15H22O/c1-11(2)13-7-9-15(3)8-6-12(10-16)4-5-14(13)15/h5-6,10-11,13H,4,7-9H2,1-3H3/t13-,15+/m1/s1
InChIKey SZOHSTQGGUHULY-HIFRSBDPSA-N
Molecular Weight 218.340 g/mol
SMILES C=12[C@](CC[C@@]2(C(C)C)[H])(CC=C(CC1)C=O)C
SPLASH splash10-05ox-6920000000-632a170cf129abfcbbd9
Source of Spectrum LQ-1992-3387-0
Wiley ID 1218285