CID 97998

3-piperidinemethanol, 1-methyl-

Structural Information

Molecular Formula
C7H15NO
SMILES
CN1CCCC(C1)CO
InChI
InChI=1S/C7H15NO/c1-8-4-2-3-7(5-8)6-9/h7,9H,2-6H2,1H3
InChIKey
UGXQXVDTGJCQHR-UHFFFAOYSA-N
Compound name
(1-methylpiperidin-3-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1679
Patents

129.11537 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 128.8
[M+Na]+ 152.104588 134.4
[M-H]- 128.108094 129.0
[M+NH4]+ 147.149193 148.9
[M+K]+ 168.078528 133.3
[M+H-H2O]+ 112.112630 123.0
[M+HCOO]- 174.113571 147.0
[M+CH3COO]- 188.129221 169.5
[M+Na-2H]- 150.090036 133.8
[M]+ 129.11482142 124.1
[M]- 129.11591858 124.1
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