CID 12236048

1-phenylcyclopropan-1-ol

Structural Information

Molecular Formula
C9H10O
SMILES
C1CC1(C2=CC=CC=C2)O
InChI
InChI=1S/C9H10O/c10-9(6-7-9)8-4-2-1-3-5-8/h1-5,10H,6-7H2
InChIKey
NZSQYBUQMZYZPK-UHFFFAOYSA-N
Compound name
1-phenylcyclopropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

137
Patents

134.07317 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.08045 125.2
[M+Na]+ 157.06239 134.9
[M-H]- 133.06589 132.1
[M+NH4]+ 152.10699 143.5
[M+K]+ 173.03633 133.0
[M+H-H2O]+ 117.07043 120.2
[M+HCOO]- 179.07137 148.9
[M+CH3COO]- 193.08702 172.7
[M+Na-2H]- 155.04784 134.6
[M]+ 134.07262 126.3
[M]- 134.07372 126.3
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

No patent data available for this compound.