CID 14999039

1,4-dimethyl-1,4-diazepan-6-amine

Structural Information

Molecular Formula
C7H17N3
SMILES
CN1CCN(CC(C1)N)C
InChI
InChI=1S/C7H17N3/c1-9-3-4-10(2)6-7(8)5-9/h7H,3-6,8H2,1-2H3
InChIKey
RWICYHQFRMCCEX-UHFFFAOYSA-N
Compound name
1,4-dimethyl-1,4-diazepan-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

143.14224 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.149516 128.8
[M+Na]+ 166.131458 133.3
[M-H]- 142.134964 130.1
[M+NH4]+ 161.176063 146.1
[M+K]+ 182.105398 136.7
[M+H-H2O]+ 126.139500 121.1
[M+HCOO]- 188.140441 146.8
[M+CH3COO]- 202.156091 180.1
[M+Na-2H]- 164.116906 132.8
[M]+ 143.14169142 120.9
[M]- 143.14278858 120.9
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