CID 146050324

2413899-74-6

Structural Information

Molecular Formula
C6H12ClNO
SMILES
C1COCCC1(CN)Cl
InChI
InChI=1S/C6H12ClNO/c7-6(5-8)1-3-9-4-2-6/h1-5,8H2
InChIKey
SRBNPRZWBAROHV-UHFFFAOYSA-N
Compound name
(4-chlorooxan-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

149.06075 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.06803 128.5
[M+Na]+ 172.04997 139.6
[M+NH4]+ 167.09457 139.4
[M+K]+ 188.02391 131.8
[M-H]- 148.05347 132.3
[M+Na-2H]- 170.03542 135.4
[M]+ 149.06020 131.5
[M]- 149.06130 131.5
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.