CID 11961584

4-(2-methyl-1,3-dioxolan-2-yl)benzaldehyde

Structural Information

Molecular Formula
C11H12O3
SMILES
CC1(OCCO1)C2=CC=C(C=C2)C=O
InChI
InChI=1S/C11H12O3/c1-11(13-6-7-14-11)10-4-2-9(8-12)3-5-10/h2-5,8H,6-7H2,1H3
InChIKey
QCBSHOMDNLCSSL-UHFFFAOYSA-N
Compound name
4-(2-methyl-1,3-dioxolan-2-yl)benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

192.07864 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.08592 139.2
[M+Na]+ 215.06786 151.8
[M+NH4]+ 210.11246 149.2
[M+K]+ 231.04180 146.2
[M-H]- 191.07136 145.0
[M+Na-2H]- 213.05331 147.0
[M]+ 192.07809 142.8
[M]- 192.07919 142.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe