CID 165755875

3-(1-phenylcyclopropyl)azetidine hydrochloride

Structural Information

Molecular Formula
C12H15N
SMILES
C1CC1(C2CNC2)C3=CC=CC=C3
InChI
InChI=1S/C12H15N/c1-2-4-10(5-3-1)12(6-7-12)11-8-13-9-11/h1-5,11,13H,6-9H2
InChIKey
QUSDAKDOTOKGGU-UHFFFAOYSA-N
Compound name
3-(1-phenylcyclopropyl)azetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.12045 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.127726 136.0
[M+Na]+ 196.109668 143.3
[M-H]- 172.113174 143.5
[M+NH4]+ 191.154273 145.2
[M+K]+ 212.083608 143.1
[M+H-H2O]+ 156.117710 124.8
[M+HCOO]- 218.118651 155.9
[M+CH3COO]- 232.134301 148.0
[M+Na-2H]- 194.095116 143.4
[M]+ 173.11990142 142.6
[M]- 173.12099858 142.6
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.