CID 23014132

2-(cyclopropylmethyl)phenol

Structural Information

Molecular Formula
C10H12O
SMILES
C1CC1CC2=CC=CC=C2O
InChI
InChI=1S/C10H12O/c11-10-4-2-1-3-9(10)7-8-5-6-8/h1-4,8,11H,5-7H2
InChIKey
OSSXBXCEVWBVFC-UHFFFAOYSA-N
Compound name
2-(cyclopropylmethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

148.08882 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.09610 127.5
[M+Na]+ 171.07804 137.0
[M-H]- 147.08154 134.1
[M+NH4]+ 166.12264 143.6
[M+K]+ 187.05198 133.8
[M+H-H2O]+ 131.08608 121.5
[M+HCOO]- 193.08702 151.2
[M+CH3COO]- 207.10267 177.0
[M+Na-2H]- 169.06349 134.9
[M]+ 148.08827 128.9
[M]- 148.08937 128.9
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