CID 9494

N,n-dipropylguanidine nitrate

Structural Information

Molecular Formula
C7H17N3
SMILES
CCCN(CCC)C(=N)N
InChI
InChI=1S/C7H17N3/c1-3-5-10(6-4-2)7(8)9/h3-6H2,1-2H3,(H3,8,9)
InChIKey
JMJVKOUWWKEIBN-UHFFFAOYSA-N
Compound name
1,1-dipropylguanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

124
Patents

143.14224 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.14952 135.5
[M+Na]+ 166.13146 140.0
[M-H]- 142.13496 136.5
[M+NH4]+ 161.17606 156.5
[M+K]+ 182.10540 140.3
[M+H-H2O]+ 126.13950 129.4
[M+HCOO]- 188.14044 161.0
[M+CH3COO]- 202.15609 186.9
[M+Na-2H]- 164.11691 139.4
[M]+ 143.14169 133.4
[M]- 143.14279 133.4
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