CID 59842458

(1,3-dimethylazetidin-3-yl)methanol

Structural Information

Molecular Formula
C6H13NO
SMILES
CC1(CN(C1)C)CO
InChI
InChI=1S/C6H13NO/c1-6(5-8)3-7(2)4-6/h8H,3-5H2,1-2H3
InChIKey
UADFQHVHTJXUKB-UHFFFAOYSA-N
Compound name
(1,3-dimethylazetidin-3-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

115.09972 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 123.4
[M+Na]+ 138.08894 129.8
[M+NH4]+ 133.13354 129.1
[M+K]+ 154.06288 125.0
[M-H]- 114.09244 121.1
[M+Na-2H]- 136.07439 127.1
[M]+ 115.09917 122.5
[M]- 115.10027 122.5
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

patents stripe