CID 11586322

[4-(prop-2-en-1-yl)phenyl]methanol

Structural Information

Molecular Formula
C10H12O
SMILES
C=CCC1=CC=C(C=C1)CO
InChI
InChI=1S/C10H12O/c1-2-3-9-4-6-10(8-11)7-5-9/h2,4-7,11H,1,3,8H2
InChIKey
SWVXBMORXRQPOF-UHFFFAOYSA-N
Compound name
(4-prop-2-enylphenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

78
Patents

148.08882 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.09610 130.2
[M+Na]+ 171.07804 138.1
[M-H]- 147.08154 132.7
[M+NH4]+ 166.12264 151.2
[M+K]+ 187.05198 135.0
[M+H-H2O]+ 131.08608 125.2
[M+HCOO]- 193.08702 153.5
[M+CH3COO]- 207.10267 174.0
[M+Na-2H]- 169.06349 136.9
[M]+ 148.08827 129.8
[M]- 148.08937 129.8
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