CID 79127575

2-[1-(aminomethyl)cyclobutyl]propan-2-ol

Structural Information

Molecular Formula
C8H17NO
SMILES
CC(C)(C1(CCC1)CN)O
InChI
InChI=1S/C8H17NO/c1-7(2,10)8(6-9)4-3-5-8/h10H,3-6,9H2,1-2H3
InChIKey
VYLBGBWPKMJYDX-UHFFFAOYSA-N
Compound name
2-[1-(aminomethyl)cyclobutyl]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.13101 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 135.7
[M+Na]+ 166.12023 140.3
[M-H]- 142.12373 137.5
[M+NH4]+ 161.16483 151.5
[M+K]+ 182.09417 142.1
[M+H-H2O]+ 126.12827 127.1
[M+HCOO]- 188.12921 154.6
[M+CH3COO]- 202.14486 178.1
[M+Na-2H]- 164.10568 141.6
[M]+ 143.13046 141.0
[M]- 143.13156 141.0
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.