CID 64870871

1,3,3-trimethyl-1,4-diazepane

Structural Information

Molecular Formula
C8H18N2
SMILES
CC1(CN(CCCN1)C)C
InChI
InChI=1S/C8H18N2/c1-8(2)7-10(3)6-4-5-9-8/h9H,4-7H2,1-3H3
InChIKey
GNFASXVYRCRJLO-UHFFFAOYSA-N
Compound name
1,3,3-trimethyl-1,4-diazepane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.147 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.15428 128.4
[M+Na]+ 165.13622 137.2
[M+NH4]+ 160.18082 137.0
[M+K]+ 181.11016 131.7
[M-H]- 141.13972 128.8
[M+Na-2H]- 163.12167 134.6
[M]+ 142.14645 129.7
[M]- 142.14755 129.7
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.