CID 71683828

2-amino-1-cyclopropyl-1-phenylethan-1-ol

Structural Information

Molecular Formula
C11H15NO
SMILES
C1CC1C(CN)(C2=CC=CC=C2)O
InChI
InChI=1S/C11H15NO/c12-8-11(13,10-6-7-10)9-4-2-1-3-5-9/h1-5,10,13H,6-8,12H2
InChIKey
WQOWZFCVILEMHI-UHFFFAOYSA-N
Compound name
2-amino-1-cyclopropyl-1-phenylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.11537 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.12265 134.3
[M+Na]+ 200.10459 142.0
[M-H]- 176.10809 140.0
[M+NH4]+ 195.14919 148.5
[M+K]+ 216.07853 138.5
[M+H-H2O]+ 160.11263 128.4
[M+HCOO]- 222.11357 156.6
[M+CH3COO]- 236.12922 183.2
[M+Na-2H]- 198.09004 141.9
[M]+ 177.11482 133.7
[M]- 177.11592 133.7
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.