CID 44835

63855-88-9

Structural Information

Molecular Formula
C16H16O
SMILES
C1C(C1C(C2=CC=CC=C2)O)C3=CC=CC=C3
InChI
InChI=1S/C16H16O/c17-16(13-9-5-2-6-10-13)15-11-14(15)12-7-3-1-4-8-12/h1-10,14-17H,11H2
InChIKey
MQINXSLAFBQJMF-UHFFFAOYSA-N
Compound name
phenyl-(2-phenylcyclopropyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.12012 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.12740 145.0
[M+Na]+ 247.10934 152.9
[M-H]- 223.11284 154.0
[M+NH4]+ 242.15394 157.6
[M+K]+ 263.08328 148.6
[M+H-H2O]+ 207.11738 137.7
[M+HCOO]- 269.11832 167.5
[M+CH3COO]- 283.13397 157.4
[M+Na-2H]- 245.09479 150.7
[M]+ 224.11957 145.3
[M]- 224.12067 145.3
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.