CID 145619392

3-cyclopropyl-4-methoxybenzaldehyde

Structural Information

Molecular Formula
C11H12O2
SMILES
COC1=C(C=C(C=C1)C=O)C2CC2
InChI
InChI=1S/C11H12O2/c1-13-11-5-2-8(7-12)6-10(11)9-3-4-9/h2,5-7,9H,3-4H2,1H3
InChIKey
FYPVFEKKSCOGHJ-UHFFFAOYSA-N
Compound name
3-cyclopropyl-4-methoxybenzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.08372 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.09100 138.2
[M+Na]+ 199.07294 153.2
[M+NH4]+ 194.11754 147.7
[M+K]+ 215.04688 147.6
[M-H]- 175.07644 148.6
[M+Na-2H]- 197.05839 148.6
[M]+ 176.08317 144.4
[M]- 176.08427 144.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.