CID 10607081

176019-54-8

Structural Information

Molecular Formula

C₁₁H₁₄O

SMILES

C[C@]1(C[C@H]1C2=CC=CC=C2)CO

InChI

InChI=1S/C11H14O/c1-11(8-12)7-10(11)9-5-3-2-4-6-9/h2-6,10,12H,7-8H2,1H3/t10-,11-/m0/s1

InChIKey

YJTZNEKUPCCLIO-QWRGUYRKSA-N

Compound name

[(1R,2S)-1-methyl-2-phenylcyclopropyl]methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 162.10446 Da
Monoisotopic Mass: 2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	163.11174	137.4
[M+Na]+	185.09368	152.1
[M+NH4]+	180.13828	148.8
[M+K]+	201.06762	144.6
[M-H]-	161.09718	148.1
[M+Na-2H]-	183.07913	149.4
[M]+	162.10391	143.9
[M]-	162.10501	143.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.