CID 12276552

1-(4-methoxyphenyl)cyclopropanol

Structural Information

Molecular Formula
C10H12O2
SMILES
COC1=CC=C(C=C1)C2(CC2)O
InChI
InChI=1S/C10H12O2/c1-12-9-4-2-8(3-5-9)10(11)6-7-10/h2-5,11H,6-7H2,1H3
InChIKey
RGKYCLBOOIINGW-UHFFFAOYSA-N
Compound name
1-(4-methoxyphenyl)cyclopropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

164.08372 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.090996 132.7
[M+Na]+ 187.072938 142.8
[M-H]- 163.076444 139.7
[M+NH4]+ 182.117543 150.0
[M+K]+ 203.046878 140.9
[M+H-H2O]+ 147.080980 127.6
[M+HCOO]- 209.081921 156.1
[M+CH3COO]- 223.097571 178.5
[M+Na-2H]- 185.058386 140.9
[M]+ 164.08317142 136.0
[M]- 164.08426858 136.0
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