CID 81580

Cyclopropyl(4-methoxyphenyl)methanone

Structural Information

Molecular Formula
C11H12O2
SMILES
COC1=CC=C(C=C1)C(=O)C2CC2
InChI
InChI=1S/C11H12O2/c1-13-10-6-4-9(5-7-10)11(12)8-2-3-8/h4-8H,2-3H2,1H3
InChIKey
YKZSVEVTRUSPOQ-UHFFFAOYSA-N
Compound name
cyclopropyl-(4-methoxyphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

6
References

77
Patents

176.08372 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.09100 139.1
[M+Na]+ 199.07294 153.4
[M+NH4]+ 194.11754 148.5
[M+K]+ 215.04688 148.3
[M-H]- 175.07644 149.2
[M+Na-2H]- 197.05839 149.3
[M]+ 176.08317 145.1
[M]- 176.08427 145.1
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