CID 79850

Cyclopropyldiphenylmethanol

Structural Information

Molecular Formula
C16H16O
SMILES
C1CC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C16H16O/c17-16(15-11-12-15,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15,17H,11-12H2
InChIKey
MFKPHBJFWOOEDT-UHFFFAOYSA-N
Compound name
cyclopropyl(diphenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

205
Patents

224.12012 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.12740 145.6
[M+Na]+ 247.10934 153.3
[M-H]- 223.11284 154.4
[M+NH4]+ 242.15394 158.0
[M+K]+ 263.08328 149.1
[M+H-H2O]+ 207.11738 138.6
[M+HCOO]- 269.11832 167.5
[M+CH3COO]- 283.13397 157.8
[M+Na-2H]- 245.09479 153.7
[M]+ 224.11957 145.6
[M]- 224.12067 145.6
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