CID 69063503

1859761-35-5

Structural Information

Molecular Formula
C7H15NO
SMILES
CC(C1(CCC1)CO)N
InChI
InChI=1S/C7H15NO/c1-6(8)7(5-9)3-2-4-7/h6,9H,2-5,8H2,1H3
InChIKey
UVLKULPGXOYKNL-UHFFFAOYSA-N
Compound name
[1-(1-aminoethyl)cyclobutyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

129.11537 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 132.5
[M+Na]+ 152.104588 136.7
[M-H]- 128.108094 134.1
[M+NH4]+ 147.149193 148.5
[M+K]+ 168.078528 138.9
[M+H-H2O]+ 112.112630 123.3
[M+HCOO]- 174.113571 152.1
[M+CH3COO]- 188.129221 175.6
[M+Na-2H]- 150.090036 136.7
[M]+ 129.11482142 137.2
[M]- 129.11591858 137.2
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