CID 65921294

2375273-17-7

Structural Information

Molecular Formula
C12H17NO
SMILES
CC(C)C1=CC=C(C=C1)C2(CNC2)O
InChI
InChI=1S/C12H17NO/c1-9(2)10-3-5-11(6-4-10)12(14)7-13-8-12/h3-6,9,13-14H,7-8H2,1-2H3
InChIKey
CXLKWQHXPBDCDT-UHFFFAOYSA-N
Compound name
3-(4-propan-2-ylphenyl)azetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.13101 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.13829 143.7
[M+Na]+ 214.12023 151.0
[M+NH4]+ 209.16483 149.2
[M+K]+ 230.09417 145.3
[M-H]- 190.12373 143.2
[M+Na-2H]- 212.10568 149.0
[M]+ 191.13046 143.5
[M]- 191.13156 143.5
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.