CID 84020749

2-[3-(propan-2-yl)azetidin-1-yl]ethan-1-ol

Structural Information

Molecular Formula
C8H17NO
SMILES
CC(C)C1CN(C1)CCO
InChI
InChI=1S/C8H17NO/c1-7(2)8-5-9(6-8)3-4-10/h7-8,10H,3-6H2,1-2H3
InChIKey
HNQBWHBJRXYVHG-UHFFFAOYSA-N
Compound name
2-(3-propan-2-ylazetidin-1-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

143.13101 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 133.9
[M+Na]+ 166.12023 138.9
[M-H]- 142.12373 134.5
[M+NH4]+ 161.16483 147.2
[M+K]+ 182.09417 141.1
[M+H-H2O]+ 126.12827 123.3
[M+HCOO]- 188.12921 151.8
[M+CH3COO]- 202.14486 178.6
[M+Na-2H]- 164.10568 137.1
[M]+ 143.13046 141.4
[M]- 143.13156 141.4
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