CID 13362458

93101-53-2

Structural Information

Molecular Formula
C8H15NO
SMILES
CC1=C(CN(CC1)C)CO
InChI
InChI=1S/C8H15NO/c1-7-3-4-9(2)5-8(7)6-10/h10H,3-6H2,1-2H3
InChIKey
VFIXKLQRWCHBNQ-UHFFFAOYSA-N
Compound name
(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

141.11537 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 130.7
[M+Na]+ 164.104588 138.0
[M-H]- 140.108094 131.6
[M+NH4]+ 159.149193 150.8
[M+K]+ 180.078528 136.4
[M+H-H2O]+ 124.112630 125.1
[M+HCOO]- 186.113571 150.1
[M+CH3COO]- 200.129221 173.3
[M+Na-2H]- 162.090036 135.6
[M]+ 141.11482142 128.2
[M]- 141.11591858 128.2
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