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]+ 144.138286 135.7
[M+Na]+ 166.120228 140.3
[M-H]- 142.123734 137.5
[M+NH4]+ 161.164833 151.5
[M+K]+ 182.094168 142.1
[M+H-H2O]+ 126.128270 127.1
[M+HCOO]- 188.129211 154.6
[M+CH3COO]- 202.144861 178.1
[M+Na-2H]- 164.105676 141.6
[M]+ 143.13046142 141.0
[M]- 143.13155858 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.