CID 11829459

1-[(methylamino)methyl]cyclopentan-1-ol

Structural Information

Molecular Formula
C7H15NO
SMILES
CNCC1(CCCC1)O
InChI
InChI=1S/C7H15NO/c1-8-6-7(9)4-2-3-5-7/h8-9H,2-6H2,1H3
InChIKey
JHJHDBGUTJWNTC-UHFFFAOYSA-N
Compound name
1-(methylaminomethyl)cyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
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 128.0
[M+Na]+ 152.104588 133.7
[M-H]- 128.108094 129.9
[M+NH4]+ 147.149193 152.6
[M+K]+ 168.078528 132.5
[M+H-H2O]+ 112.112630 123.6
[M+HCOO]- 174.113571 150.7
[M+CH3COO]- 188.129221 169.9
[M+Na-2H]- 150.090036 134.0
[M]+ 129.11482142 124.0
[M]- 129.11591858 124.0
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

patents stripe