CID 17973047

4-(1-methylcyclopropyl)phenol

Structural Information

Molecular Formula
C10H12O
SMILES
CC1(CC1)C2=CC=C(C=C2)O
InChI
InChI=1S/C10H12O/c1-10(6-7-10)8-2-4-9(11)5-3-8/h2-5,11H,6-7H2,1H3
InChIKey
URBFAECGYIAXDC-UHFFFAOYSA-N
Compound name
4-(1-methylcyclopropyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

86
Patents

148.08882 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.096096 128.6
[M+Na]+ 171.078038 138.8
[M-H]- 147.081544 135.7
[M+NH4]+ 166.122643 146.7
[M+K]+ 187.051978 136.6
[M+H-H2O]+ 131.086080 123.7
[M+HCOO]- 193.087021 151.9
[M+CH3COO]- 207.102671 176.6
[M+Na-2H]- 169.063486 136.9
[M]+ 148.08827142 130.5
[M]- 148.08936858 130.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe